Mellin Moments of Heavy Flavor Contributions to F2(x, Q2) at NNLO Dissertation zur Erlangung des wissenschaftlichen Grades Dr. rer. nat. der Fakulta¨t Physik der Technischen Universita¨t Dortmund vorgelegt von Sebastian Werner Gerhard Kleina,b geboren am 23.01.1980 in Karlsruhe Betreuer: PD Dr. habil. Johannes Blu¨mleina,b aTechnische Universita¨t Dortmund, Fakulta¨t Physik Otto-Hahn-Str. 4, D-44227 Dortmund bDeutsches Elektronen–Synchrotron, DESY Platanenallee 6, D–15738 Zeuthen eingereicht am 5. Juni 2009 Contents 1 Introduction 5 2 Deeply Inelastic Scattering 12 2.1 Kinematics and Cross Section . . . . . . . . . . . . . . . . . . . . . . . 13 2.2 The Parton Model . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 17 2.2.1 Validity of the Parton Model . . . . . . . . . . . . . . . . . . . . . . 20 2.3 The Light–Cone Expansion . . . . . . . . . . . . . . . . . . . . . . . . 21 2.3.1 Light–Cone Dominance . . . . . . . . . . . . . . . . . . . . . . . . . 23 2.3.2 A Simple Example . . . . . . . . . . . . . . . . . . . . . . . . . . . 24 2.3.3 The Light–Cone Expansion applied to DIS . . . . . . . . . . . . . . 26 2.4 RGE–improved Parton Model and Anomalous Dimensions . . . . 29 3 Heavy Quark Production in DIS 33 3.1 Electroproduction of Heavy Quarks . . . . . . . . . . . . . . . . . . . 34 3.2 Asymptotic Heavy Quark Coefficient Functions . . . . . . . . . . . 37 3.3 Heavy Quark Parton Densities . . . . . . . . . . . . . . . . . . . . . . 41 4 Renormalization of Composite Operator Matrix Elements 44 4.1 Regularization Scheme . . . . . . . . . . . . . . . . . . . . . . . . . . . 45 4.2 Projectors . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 46 4.3 Renormalization of the Mass . . . . . . . . . . . . . . . . . . . . . . . 48 4.4 Renormalization of the Coupling . . . . . . . . . . . . . . . . . . . . . 49 4.5 Operator Renormalization . . . . . . . . . . . . . . . . . . . . . . . . . 52 4.6 Mass Factorization . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 55 4.7 General Structure of the Massive Operator Matrix Elements . . . 57 4.7.1 Self–energy contributions . . . . . . . . . . . . . . . . . . . . . . . . 58 4.7.2 ANSqq,Q . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 59 4.7.3 APSQq and APSqq,Q . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 60 4.7.4 AQg and Aqg,Q . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 62 4.7.5 Agq,Q . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 64 4.7.6 Agg,Q . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 66 5 Representation in Different Renormalization Schemes 69 5.1 Scheme Dependence at NLO . . . . . . . . . . . . . . . . . . . . . . . . 71 6 Calculation of the Massive Operator Matrix Elements up to O(a2sε) 74 6.1 Representation in Terms of Hypergeometric Functions . . . . . . . 74 6.2 Difference Equations and Infinite Summation . . . . . . . . . . . . . 78 6.2.1 The Sigma-Approach . . . . . . . . . . . . . . . . . . . . . . . . . . 79 6.2.2 Alternative Approaches . . . . . . . . . . . . . . . . . . . . . . . . . 81 6.3 Results . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 83 6.4 Checks on the Calculation . . . . . . . . . . . . . . . . . . . . . . . . . 93 1 7 Calculation of Moments at O(a3s) 95 7.1 Generation of Diagrams . . . . . . . . . . . . . . . . . . . . . . . . . . 95 7.2 Calculation of Fixed 3–Loop Moments Using MATAD . . . . . . . . 98 7.3 Results . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 101 8 Heavy Flavor Corrections to Polarized Deep-Inelastic Scattering 106 8.1 Polarized Scattering Cross Sections . . . . . . . . . . . . . . . . . . . 107 8.2 Polarized Massive Operator Matrix Elements . . . . . . . . . . . . . 109 8.2.1 ∆A(2),NSqq,Q . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110 8.2.2 ∆A(2)Qg . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 110 8.2.3 ∆A(2),PSQq . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 114 9 Heavy Flavor Contributions to Transversity 118 10 First Steps Towards a Calculation of A(3)ij for all Moments. 123 10.1 Results for all–N Using Generalized Hypergeometric Functions . 123 10.2 Reconstructing General–N Relations from a Finite Number of Mellin–Moments . . . . . . . . . . . . . . . 127 10.2.1 Single Scale Feynman Integrals as Recurrent Quantities . . . . . . . 128 10.2.2 Establishing and Solving Recurrences . . . . . . . . . . . . . . . . . 128 10.2.3 Determination of the 3-Loop Anomalous Dimensions and Wilson Coefficients . . . . . . . . . . . . . . . . . . . . . . . . . 130 11 Conclusions 132 A Conventions 137 B Feynman Rules 139 C Special Functions 142 C.1 The Γ–function . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 142 C.2 The Generalized Hypergeometric Function . . . . . . . . . . . . . . . . . . 143 C.3 Mellin–Barnes Integrals . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 144 C.4 Harmonic Sums and Nielsen–Integrals . . . . . . . . . . . . . . . . . . . . . 144 D Finite and Infinite Sums 147 E Moments of the Fermionic Contributions to the 3–Loop Anomalous Dimensions 149 F The O(ε0) Contributions to ˆˆA (3) ij 155 G 3–loop Moments for Transversity 171 List of Figures 1 Schematic graph of deeply inelastic scattering for single boson exchange. . . . 13 2 Deeply inelastic electron-proton scattering in the parton model. . . . . . . . . 18 2 3 Schematic picture of the optical theorem. . . . . . . . . . . . . . . . . . . . . 22 4 Integration contour in the complex x′-plane. . . . . . . . . . . . . . . . . . . 25 5 LO intrinsic heavy quark production. . . . . . . . . . . . . . . . . . . . . . . 34 6 LO extrinsic heavy quark production. . . . . . . . . . . . . . . . . . . . . . . 36 7 O(a2s) virtual heavy quark corrections. . . . . . . . . . . . . . . . . . . . . . . 71 8 Examples for 2–loop diagrams contributing to the massive OMEs. . . . . . . . 75 9 Basic 2–loop massive tadpole . . . . . . . . . . . . . . . . . . . . . . . . . . 75 10 Examples for 3–loop diagrams contributing to the massive OMEs. . . . . . . . 95 11 Diagrams contributing to H(1)g,(2,L) via the optical theorem. . . . . . . . . . . . 95 12 Diagrams contributing to A(1)Qg. . . . . . . . . . . . . . . . . . . . . . . . . . 96 13 Generation of the operator insertion. . . . . . . . . . . . . . . . . . . . . . . 96 14 2–Loop topologies for MATAD . . . . . . . . . . . . . . . . . . . . . . . . . 97 15 Master 3–loop topology for MATAD. . . . . . . . . . . . . . . . . . . . . . . 97 16 Additional 3–loop topologies for MATAD. . . . . . . . . . . . . . . . . . . . . 98 17 Basic 3–loop topologies . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 123 18 3–loop ladder graph . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 124 19 Example 3–loop graph . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 125 20 Feynman rules of QCD. . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 139 21 Feynman rules for quarkonic composite operators. . . . . . . . . . . . . . . . 140 22 Feynman rules for gluonic composite operators. . . . . . . . . . . . . . . . . . 141 List of Tables 1 Complexity of the results for the individual diagrams contributing to A(2)Qg . . . 86 2 Number of diagrams contributing to the 3–loop massive OMEs. . . . . . . . 96 3 Numerical values for moments of individual diagrams of ∆ ˆˆA (2) Qg. . . . . . . . . 115 3 1 Introduction Quantum Chromodynamics (QCD) has been established as the theory of the strong in- teraction and explains the properties of hadrons, such as the proton or the neutron, in particular at short distances. Hadrons are composite objects and made up of quarks and antiquarks, which are bound together by the exchange of gluons, the gauge field of the strong force. The corresponding charge is called color, leading to a SU(3)c gauge theory. This is analogous to the electric charge, which induces the U(1) gauge group of electro- magnetism. The path to the discovery of QCD started in the 1960ies. By that time, a large amount of hadrons had been observed in cosmic ray and accelerator experiments. Hadrons are strongly interacting particles which occur as mesons (spin = 0, 1) or baryons (spin = 1/2, 3/2). In the early 1960ies investigations were undertaken to classify all hadrons, based on their properties such as flavor– and spin quantum numbers and masses. In 1964, M. Gell-Mann, [1], and G. Zweig, [2], proposed the quark model as a mathemat- ical description for these hadrons. Three fractionally charged quark flavors, up (u), down (d) and strange (s), known as valence quarks, were sufficient to describe the quantum numbers of the hadron spectrum which had been discovered by then. Baryons are thus considered as bound states of three quarks and mesons of a quark-antiquark pair. Assum- ing an approximate SU(3) flavor symmetry, “the eightfold way”, [3–5], mass formulas for hadrons built on the basis of quark states could be derived. A great success for the quark model was marked by the prediction of the mass of the Ω−-baryon before it was finally observed, [6]. In the same year, Gu¨rsey and Radicati, [7], introduced spin into the model and proposed a larger SU(6)spin−flavor = SU(2)spin⊗SU(3)flavor symmetry. This allowed the unification of the mass formulas for the spin–1/2 and spin–3/2 baryons and provided the tool to calculate the ratio of the magnetic moments of the proton and the neutron to be ≈ −3/2, which is in agreement with experiment within 3%, [8,9]. However, this theory required the quarks that gave the correct low-lying baryons to be in a symmetric state under permutations, which contradicts the spin–statistics theorem, [10], since quarks have to be fermions. Greenberg, [11], resolved this contradiction by introducing a “symmetric quark model”. It allows quarks to have a new hidden three–valued charge, called color, which is expressed in terms of parafermi statistics. Finally, in 1965, Nambu, [12], and Han and Nambu, [13], proposed a new symmetry, SU(3)color, which makes the hidden three–valued charge degree of freedom explicit and is equivalent to Greenberg’s descrip- tion. Since there was no explicit experimental evidence of this new degree of freedom, the assumption was made that all physical bound states must be color-neutral, [12–14]. The possibility to study the substructure of nucleons arose at the end of the 1960ies with the advent of the Stanford Linear Accelerator SLAC, [15]. This facility allowed to perform deeply inelastic lepton-nucleon scattering (DIS) experiments at much higher res- olutions than previously possible. The cross section can be parametrized quite generally in terms of several structure functions Fi of the nucleon, [16]. These were measured for the proton by the SLAC-MIT experiments and depend both on the energy transfer ν and the 4-momentum transfer q2 = −Q2 from the lepton to the nucleon in the nucleon’s rest frame. In the Bjorken limit, {Q2, ν → ∞, Q2/ν = fixed}, [17], it was found that the structure functions depend on the ratio of Q2 and ν only, Fi(ν,Q2) = Fi(Q2/ν). This 5 phenomenon was called scaling, [18] cf. also [19], and had been predicted by Bjorken in his field theoretic analysis based on current algebra, [17]. As the relevant parame- ter in the deep-inelastic limit he introduced the Bjorken-scaling variable x = Q2/2Mν, where M is the mass of the nucleon. After scaling was discovered, R. Feynman gave a phenomenological explanation for this behavior of the structure functions within the parton model, [20–22]. According to this model, the proton consists of several point-like constituents, the partons. His assumption was that during the interaction time - which is very short since high energies are involved - these partons behave as free particles off which the electrons scatter elastically. Therefore, the total cross section is just the incoherent sum of the individual electron-parton cross-sections, weighted by the prob- ability to find the particular parton inside the proton. The latter is described by the parton density fi(z). It denotes the probability to find parton i in the proton, carrying the fraction z of the total proton momentum P . In the limit considered by Feynman, z becomes equal to x, giving an explanation for scaling. This is a direct consequence of the rigid correlation Mν = q.P , as observed in experiment. Even more important for the acceptance of the quark parton model was the observation that the Callan-Gross relation, [23], holds, namely that the longitudinal structure function FL vanishes in the situation of strict scaling. This experimental result favored the idea of the proton con- taining spin–1/2, point-like constituents and ruled out different approaches, such as the algebra of fields, [24], or explanations assuming vector–meson dominance, [25]. Finally, Bjorken and Paschos, [26], linked the parton model to the group theoretic approach by identifying quarks and partons. Today QCD forms one part of the Standard Model of elementary particle physics, sup- plementing the electroweak SUL(2)×UY (1) sector, which had been proposed by S. Wein- berg in 1967, [27], extending earlier work by S. Glashow, [28], cf. also [29], for the leptonic sector. This theory was proved to be renormalizable by G. t’Hooft and M. Veltman in 1972, [30], see also [31], if anomalies are canceled, [32,33], requiring an appropriate repre- sentation for all fermions. G. t’ Hooft also proved renormalization for massless Yang-Mills theories, [34]. These gauge theories had first been studied by C.N. Yang and R.L. Mills in 1954, [35], and have the distinctive property that their gauge group is non-abelian, leading to interactions between the gauge–bosons, [14], contrary to the case of Quan- tum Electrodynamics. In 1972/73, M. Gell-Mann, H. Fritzsch and H. Leutwyler, [36], cf. also [12], proposed to gauge color which led to an extension of the Standard Model to SUL(2)×UY (1)×SUc(3), including the strongly interacting sector. The dynamical theory of quarks and gluons, Quantum Chromodynamics, is thus a massless Yang-Mills theory which describes the interaction of different quark flavors via massless gluons. Among the semi-simple compact Lie-groups, SU(3)c turns out to be the only possible gauge group for this theory, cf. [37, 38]. In 1973, D. Gross and F. Wilczek, [39], and H. Politzer, [40], proved by a 1-loop calculation that Quantum Chromodynamics is an asymptotically free gauge theory, cf. also [41], which allows to perform perturbative calculations for processes at large enough scales. There, the strong coupling constant becomes a sufficiently small perturbative parameter. In the beginning, QCD was not an experimentally well–established theory, which was mainly due to its non–perturbative nature. The large value of the strong coupling con- stant over a wide energy range prevents one from using perturbation theory. In the course of performing precision tests of QCD, the operator product expansion near the 6 light–cone, the light–cone expansion (LCE), [42], proved to be important. By applying it to deep–inelastic processes, one facilitates a separation of hadronic bound state effects and the short distance effects. This is possible, since the cross sections of deeply inelastic processes receive contributions from two different resolution scales µ2. One is the short distance region, where perturbative techniques can be applied. The other describes the long distance region. Here bound state effects are essential and a perturbative treatment is not possible due to the large coupling involved. By means of the LCE, the two energy scales of the process are associated with two different quantities: the Wilson coefficients and the hadronic operator matrix elements or parton densities. The former contain the large scale contributions and can therefore be calculated perturbatively, whereas the lat- ter describe the low scale behavior and are quantities which have to be extracted from experimental data or can be calculated by applying rigorous non–perturbative methods. Using the LCE, one may derive Feynman’s parton model and show the equivalence of the approaches by Feynman and Bjorken in the twist–2 approximation, [43]. The LCE also allows to go beyond the naive partonic description, which is formulated in the renormal- ization group improved parton model. Shortly after the formulation of QCD, logarithmic scaling violations of the deep inelastic cross section where observed, [44], which had to be expected since QCD is not an essentially free field theory, neither is it conformally invari- ant, [45]. The theoretical explanation involves the calculation of higher order corrections to the Wilson coefficients as well as to the anomalous dimensions of the composite oper- ators emerging in the LCE, [46], and predicts the correct logarithmic Q2 dependence of the structure functions. In fact, the prediction of scaling violations is one of the strongest experimental evidences for QCD. Thus deeply inelastic scattering played a crucial role in formulating and testing QCD as the theory governing the dynamics of quark systems. Its two most important prop- erties are the confinement postulate - all physical states have to be color singlets - and asymptotic freedom - the strength of the interaction becomes weaker at higher scales, i.e. at shorter distances, cf. e.g. [37,47–56]. An important step toward completing the Standard Model were the observations of the three heavy quarks charm (c), bottom (b) and top (t). In 1974, two narrow resonances, called Ψ and Ψ′, were observed at SLAC in e+e− collisions at 3.1 GeV and 3.7 GeV, respec- tively, [57]. At the same time another resonance called J was discovered in proton-proton collisions at BNL, [58], which turned out to be the same particle. Its existence could not be explained in terms of the three known quark flavors and was interpreted as a meson con- sisting of a new quark, the charm quark. This was an important success of the Standard Model since the existence of the charm had been postulated before, [59]. It is necessary to cancel anomalies for the 2nd family as well as for the GIM–mechanism, [60], in order to explain the absence of flavor changing neutral currents. With its mass of mc ≈ 1.3 GeV it is much heavier than the light quarks, mu ≈ 2 MeV ,md ≈ 5 MeV ,ms ≈ 104 MeV, [61], and heavier than the nucleons. In later experiments, two other heavy quarks were de- tected. In 1977, the Υ (= bb) resonance was observed at FERMILAB, [62], and interpreted as a bound state of the even heavier bottom quark, with mb ≈ 4.2 GeV, [61]. Ultimately, the quark picture was completed in case of three fermionic families by the discovery of the heaviest quark, the top-quark, in pp collisions at the TEVATRON in 1995, [63]. Its mass is given by roughly mt ≈ 171 GeV, [61]. Due to their large masses, heavy quarks cannot be considered as constituents of hadrons at rest or bound in atomic nuclei. They are rather excited in high energy experiments and may form short-lived hadrons, with the 7 exception of the top-quark, which decays before it can form a bound state. The theoretical calculation in this thesis relates to the production of heavy quarks in unpolarized deeply inelastic scattering via single photon exchange. In this case, the double differential scattering cross-section can be expressed in terms of the structure functions F2(x,Q2) and FL(x,Q2). Throughout the last forty years, many DIS experi- ments have been performed, [44, 64–74]. The proton was probed to shortest distances at the Hadron-Elektron-Ring-Anlage HERA at DESY in Hamburg, [75–79]. In these experi- ments, a large amount of data has been acquired, and in the case of HERA it is still being processed, especially for those of the last running period, which was also devoted to the measurement of FL(x,Q2), [80]. Up to now, the structure function F2(x,Q2) is measured in a wide kinematic region, [61], whereas FL(x,Q2) was mainly measured in fixed target experiments, [81], and determined in the region of large ν, [82]. In the analysis of DIS data, the contributions of heavy quarks play an important role, cf. e.g. [83–87]. One finds that the scaling violations of the heavy quark contributions differ significantly from those of the light partons in a rather wide range starting from lower values of Q2. This demands a detailed description. Additionally, it turns out that the heavy quark contri- butions to the structure functions may amount up to 25-35%, especially in the small–x region, [85,86,88,89], which requires a more precise theoretical evaluation of these terms. Due to the kinematic range of HERA and the previous DIS experiments, charm is pro- duced much more abundantly and gives a higher contribution to the cross section than bottom, [86]. Therefore we subsequently limit our discussion to one species of a heavy quark. Intrinsic heavy quark production is not considered, since data from HERA show that this production mechanism hardly gives any contribution, cf. [90, 91]. The need for considering heavy quark production has several aspects. One of them is to obtain a better description of heavy flavor production and its contribution to the structure functions of the nucleon. On the other hand, increasing our knowledge on the perturbative part of deep–inelastic processes allows for a more precise determination of the QCD–scale ΛQCD and the strong coupling constant αs, as well as of the parton–densities from experimental data. For the former, sufficient knowledge of the NNLO massive corrections in DIS is required to control the theory–errors on the level of the experimental accuracy and be- low, [92–100]. The parton distribution functions are process independent quantities and can be used to describe not only deeply inelastic scattering, but also a large variety of scat- tering events at (anti–)proton–proton colliders such as the TEVATRON at FERMILAB, and the Large–Hadron–Collider (LHC) at CERN, [87]. Heavy quark production is well suited to extract the gluon density since at leading order (LO) only the photon–gluon fusion pro- cess contributes to the cross section, [101,102]. Next-to-leading order (NLO) calculations, as performed in Refs. [103], showed that this process is still dominant, although now other processes contribute, too. The gluon density plays a special role, since it carries roughly 50 % of the proton momentum, as data from FERMILAB and CERN showed already in the 1970ies, [104]. Improved knowledge on the gluon distribution G(x,Q2) is also necessary to describe gluon-initiated processes at the TEVATRON and at the LHC. The study of heavy quark production will also help to further understand the small-x behavior of the structure functions, showing a steep rise, which is mainly attributed to properties of the gluon density. 8 The perturbatively calculable contributions to the DIS cross section are the Wilson coefficients. In case of light flavors only, these are denoted by C(q,g),(2,L)(x,Q2/µ2) 1 and at present they are known up to the third order in the strong coupling constant, [105–115]. Including massive quarks into the analysis, the corresponding terms are known exactly at NLO. The LO terms have been derived in the late seventies, [101, 102], and the NLO corrections semi–analytically in z–space in the mid–90ies, [103]. A fast numerical im- plementation was given in [116]. In order to describe DIS at the level of twist τ = 2, also the anomalous dimensions of the local composite operators emerging in the LCE are needed. These have to be combined with the Wilson coefficients and describe, e.g., the scaling violations of the structure functions and parton densities, [46]. This description is equivalent to the picture in z–space in terms of the splitting functions, [117]. The unpolarized anomalous dimensions are known up to NNLO 2. At leading, [46], and at next–to–leading–order level, [119–123], they have been known for a long time and were confirmed several times. The NNLO anomalous dimension were calculated by Vermaseren et. al. First, the fixed moments were calculated in Refs. [111, 112, 114] and the complete result was obtained in Refs. [124,125]. The main parts of this thesis are the extension of the description of the contributions of heavy quark mass–effects to the deep–inelastic Wilson coefficients to NNLO. In course of that, we also obtain a first independent calculation of fixed moments of the fermionic parts of the NNLO anomalous dimensions given in Refs. [111,112] before. The calculation of the 3-loop heavy flavor Wilson coefficients in the whole Q2 region is currently not within reach. However, as noticed in Ref. [126], a very precise description of the heavy flavor Wilson coefficients contributing to the structure function F2(x,Q2) at NLO is obtained for Q2 >∼ 10 m2Q, disregarding the power corrections ∝ (m2Q/Q2)k, k ≥ 1. If one considers the charm quark, this covers an important region for deep–inelastic physics at HERA. In this limit, the massive Wilson coefficients factorize into universal massive operator matrix elements (OMEs) Aij(x, µ2/m2Q) and the light flavor Wilson coefficients C(q,g),(2,L)(x,Q2/µ2). The former are process independent quantities and describe all quark mass effects. They are given by matrix elements of the leading twist local composite op- erators Oi between partonic states j (i, j = q, g), including quark masses. The process dependence is described by the massless Wilson coefficients. This factorization has been applied in Ref. [127] to obtain the asymptotic limit for F ccL (x,Q2) at NNLO. However, un- like the case for F cc2 , the asymptotic result in this case is only valid for much higher values Q2 >∼ 800 m2Q, outside the kinematic domain at HERA for this quantity. An analytic result for the NLO quarkonic massive operator matrix elements Aqj needed for the description of the structure functions at this order was derived in Ref. [126] and confirmed in Ref. [128]. A related application of the massive OMEs concerns the formulation of a variable flavor number scheme (VFNS) to describe parton densities of massive quarks at sufficiently high scales. This procedure has been described in detail in Ref. [129], where the remaining gluonic massive OMEs Agj were calculated up to 2–loop order, thereby giving a full NLO description. This calculation was confirmed and extended in [130]. In this work, fixed moments of all contributing massive OMEs at the 3–loop level are calculated and presented, which is a new result, [131–134]. The OMEs are then matched 1q=quark, g=gluon 2In Ref. [118], the 2nd moment of the 4–loop NS+ anomalous dimension was calculated. 9 with the corresponding known O(α3s) light flavor Wilson coefficients to obtain the heavy flavor Wilson coefficients in the limit Q2 ≫ m2, which leads to a precise description for Q2/m2 >∼ 10 in case of F2(x,Q2). It is now possible to calculate all logarithmic contribu- tions ∝ ln(Q2/m2)k to the massive Wilson coefficients in the asymptotic region for general values of the Mellin variable N . This applies as well for a large part of the constant term, where also the O(ε) contributions at the 2–loop level occur. The first calculation of the latter for all–N forms a part of this thesis, too, [130, 131, 133, 135–137]. Thus only the constant terms of the unrenormalized 3–loop results are at present only known for fixed moments. Since the OMEs are given by the twist τ = 2 composite operators between on–shell partonic states, also fixed moments of the fermionic contributions to the NNLO unpolarized anomalous are obtained, which are thereby confirmed for the first time in an independent calculation, [131–134]. A more technical aspect of this thesis is the study of the mathematical structure of single scale quantities in renormalizable quantum field theories, [138–141]. One finds that the known results for a large number of different hard scattering processes are most simply expressed in terms of nested harmonic sums, cf. [142, 143]. This holds at least up to 3– loop order for massless Yang–Mills theories, cf. [95, 115, 124, 125, 138, 144, 145], including the 3–loop Wilson coefficients and anomalous dimensions. By studying properties of harmonic sums, one may thus obtain significant simplifications, [121], since they obey algebraic, [146], and structural relations, [147,148]. Performing the calculation in Mellin– space one is naturally led to harmonic sums, which is an approach we thoroughly adopt in our calculation. In course of this, new types of infinite sums occur if compared to massless calculations. In the latter case, summation algorithms such as presented in Refs. [143, 149, 150] may be used to calculate the respective sums. The new sums which emerge were calculated using the recent summation package Sigma, [151–154], written in MATHEMATICA, which opens up completely new possibilities in symbolic summation and has been tested extensively through this work, [139]. For fixed values of N , single scale quantities reduce to zero–scale quantities, which can be expressed by rational numbers and certain special numbers as multiple zeta values (MZVs), [155,156], and related quantities. Zero scale problems are much easier to calcu- late than single scale problems. By working in Mellin–space, single scale quantities are discrete and one can seek a description in terms of difference equations. One may think of an automated reconstruction of the all–N relation out of a finite number of Mellin moments given in analytic form. This is possible for recurrent quantities. At least up to 3-loop order, presumably to even higher orders, single scale quantities belong to this class. In this work, [140,141], we report on a general algorithm for this purpose, which we applied to a problem being currently one of the most sophisticated ones: the determina- tion of the anomalous dimensions and Wilson coefficients to 3–loop order for unpolarized deeply-inelastic scattering, [115,124,125]. The thesis is based on the publications Refs. [130, 134, 137, 141], the conference con- tributions [131–133, 135, 136, 138–140, 157, 158] and the papers in preparation [159, 160]. It is organized as follows. Deeply inelastic scattering within the parton model, the LCE and how one obtains improved results using the renormalization group are described in Section 2. Section 3 is devoted to the production mechanisms of heavy quarks and their contributions to the cross section. We also discuss the framework of obtaining the heavy flavor Wilson coefficients using massive OMEs in the asymptotic limit Q2 ≫ m2Q and com- 10 ment on the different schemes one may apply to treat heavy quark production, [130,134]. The massive operator matrix elements are considered in Section 4 and we describe in detail the renormalization of these objects to 3–loop order, cf. [130–134,137]. Section 5 contains transformation formulas between the different renormalization schemes. We clarify an apparent inconsistency which we find in the renormalization of the massive contributions to the NLO Wilson coefficients given in Refs. [103] and the massive OMEs as presented in Refs. [126, 129]. This is due to the renormalization scheme chosen, cf. Ref. [130, 134]. In Section 6 the calculation and the results for the 2–loop massive operator matrix ele- ments up to O(ε) in dimensional regularization are presented. This confirms the results of Ref. [129], cf. [130]. The O(ε) terms are new results and are needed for renormalization at O(α3s), cf. [130, 131, 133, 135–137]. We describe the calculation using hypergeometric functions to set up infinite sums containing the parameter N as well. These sums are solved using the summation package Sigma, cf. [137,139]. All sums can then be expressed in terms of nested harmonic sums. The same structure is expected for the 3–loop terms, of which we calculate fixed moments (N = 2, ..., 10(14)) using the programs QGRAF, [161], FORM, [162,163], and MATAD, [164] in Section 7, cf. [131–134]. Thus we confirm the cor- responding moments of the fermionic contributions to all unpolarized 3–loop anomalous dimensions which have been calculated before in Refs. [111,112,114,124,125]. In Section 8 we calculate the asymptotic heavy flavor Wilson coefficients for the polarized structure function g1(x,Q2) to O(α2s) following Ref. [165] and compare them with the results given there. We newly present the terms of O(α2sε) which contribute to the polarized massive OMEs at O(α3s) through renormalization, [157–159]. One may also consider the local flavor non–singlet tensor operator for transversity, [166]. This is done in Section 9. We derive the corresponding massive OMEs for general values of N up to O(α2sε) and for the fixed moments N = 1 . . . 13 at O(α3s), [160]. A calculation keeping the full N depen- dence has not been performed yet. In Section 10 we describe several steps which have been undertaken in this direction so far. This involves the calculation of several non– trivial 3–loop scalar integrals for all N and the description of a technique to reconstruct the complete result starting from a fixed number of moments, cf. [140, 141]. Section 11 contains the conclusions. Our conventions are summarized in Appendix A. The set of Feynman–rules used, in particular for the composite operators, is given in Appendix B. In Appendix C we summarize properties of special functions which frequently occurred in this work. Appendix D contains examples of different types of infinite sums which had to be computed in the present calculation. The main results are shown in Appendices E– G: various anomalous dimensions and the constant contributions of the different massive OMEs for fixed values of N at O(α3s). All Figures in this work have been drawn using Axodraw, [167]. 11 2 Deeply Inelastic Scattering Deep–inelastic scattering experiments provide one of the cleanest possibilities to probe the space–like short distance structure of hadrons through the reactions l±N → l± +X (2.1) νl(νl)N → l∓ +X (2.2) l∓N → νl(νl) +X , (2.3) with l = e, µ, νl = νe,µ,τ , N = p, d or a nucleus, and X the inclusive hadronic final state. The 4-momentum transfers q2 = −Q2 involved are at least of the order of Q2 ≥ 4 GeV2 and one may resolve spatial scales of approximately 1/ √ Q2. The different deep inelastic charged– and neutral current reactions offer complementary sensitivity to unfold the quark flavor and gluonic structure of the nucleons. Furthermore, polarized lepton scattering off polarized targets is studied in order to investigate the spin structure of the nucleons. The electron–proton experiments performed at SLAC in 1968, [15, 18], cf. also [19], and at DESY, [168], found the famous scaling behavior of the structure functions which had been predicted by Bjorken before, [17]. These measurements led to the creation of the parton model, [20, 21, 26]. Several years later, after a series of experiments had confirmed its main predictions, the partons were identified with the quarks, anti-quarks and gluons as real quantum fields, which are confined inside hadrons. Being formerly merely mathematical objects, [1,2], they became essential building blocks of the Standard Model of elementary particle physics, besides the leptons and the electroweak gauge fields, thereby solving the anomaly-problem, [32,33]. In the following years, more studies were undertaken at higher energies, such as the electron–proton/neutron scattering experiments at SLAC, [64]. Muons were used as probes of the nucleons by EMC, [65], BCDMS, [66], and NMC, [67], at the SPS, [169], at CERN, as well as by the E26–, [44,170], CHIO–, [68], and E665–, [69], collaborations at FERMILAB. For a general review of µ± N–scattering, see [171]. The latter experiments were augmented by several high energy neutrino scattering experiments by the CHARM– and CDHSW– collaborations, [70, 71, 172], and the WA21/25–experiments, [72, 173], at the SPS, and by the CCFR–collaboration, [73, 174], at FERMILAB. Further results on neutrinos were reported in Refs. [74], cf. also [175]. The data of these experiments confirmed QCD as the theory describing the strong interactions within hadrons, most notably by the observation of logarithmic scaling violations of the structure functions at higher energies and lower values of x, which had been precisely predicted by theoretical calculations, [46]. All these experiments had in common that they were fixed target experi- ments and therefore could only probe a limited region of phase space, up to x ≥ 10−3, Q2 ≤ 500GeV2. The first electron–proton collider experiments became possible with the advent of the HERA facility, which began operating in the beginning of the 1990ies at DESY, [75]. This allowed measurements at much larger values of Q2 and at far smaller values of x than before, x ≥ 10−4, Q2 ≤ 20000GeV2. The physics potential for the deep–inelastic experiments at HERA was studied during a series of work- shops, see [176–180]. HERA collected a vast amount of data until its shutdown in 2007, a part of which is still being analyzed, reaching unprecedented experimental precisions below the level of 1 %. Two general purpose experiments to study inclusive and various semi-inclusive unpolarized deep–inelastic reactions, H1, [76], and ZEUS, [77], were per- formed. Both experiments measured the structure functions F2,L(x,Q2) as well as the 12 heavy quark contributions to these structure functions to high precision. The theoretical calculations in this thesis are important for the analysis and understanding of the latter, as will be outlined in Section 3. The HERMES–experiment, [78], studied scattering of polarized electrons and positrons off polarized gas–targets. HERA-B, [79], was dedicated to the study of CP–violations in the B–sector. In the following, we give a brief introduction into the theory of DIS and the theoretical tools which are used to predict the properties of structure functions, such as asymptotic scaling and scaling violations. In Section 2.1, we discuss the kinematics of the DIS process and derive the cross section for unpolarized electromagnetic electron-proton scattering. In Section 2.2, we give a description of the naive parton model, which was employed to explain the results obtained at SLAC and gave a first correct qualitative prediction of the observed experimental data. A rigorous treatment of DIS can be obtained by applying the light–cone expansion to the forward Compton amplitude, [42], which is described in Section 2.3. This is equivalent to the QCD–improved parton model at the level of twist τ = 2, cf. e.g. [37,38,54,181]. One obtains evolution equations for the structure functions and the parton densities with respect to the mass scales considered. The evolution is governed by the splitting functions, [117], or the anomalous dimensions, [46], cf. Section 2.4. 2.1 Kinematics and Cross Section The schematic diagram for the Born cross section of DIS is shown in Figure 1 for single gauge boson exchange. A lepton with momentum l scatters off a nucleon of mass M P } PF q l l′ Figure 1: Schematic graph of deeply inelastic scattering for single boson exchange. and momentum P via the exchange of a virtual vector boson with momentum q. The momenta of the outgoing lepton and the set of hadrons are given by l′ and PF , respec- tively. Here F can consist of any combination of hadronic final states allowed by quantum number conservation. We consider inclusive final states and thus all the hadronic states contributing to F are summed over. The kinematics of the process can be measured from the scattered lepton or the hadronic final states, cf. e.g. [182–184], depending on the re- spective experiment. The virtual vector boson has space-like momentum with a virtuality Q2 Q2 ≡ −q2 , q = l − l′ . (2.4) 13 There are two additional independent kinematic variables for which we choose s ≡ (P + l)2 , (2.5) W 2 ≡ (P + q)2 = P 2F . (2.6) Here, s is the total cms energy squared and W denotes the invariant mass of the hadronic final state. In order to describe the process, one usually refers to Bjorken’s scaling variable x, the inelasticity y, and the total energy transfer ν of the lepton to the nucleon in the nucleon’s rest frame, [185]. They are defined by ν ≡ P.qM = W 2 +Q2 −M2 2M , (2.7) x ≡ −q 2 2P.q = Q2 2Mν = Q2 W 2 +Q2 −M2 , (2.8) y ≡ P.qP.l = 2Mν s−M2 = W 2 +Q2 −M2 s−M2 , (2.9) where lepton masses are disregarded. In general, the virtual vector boson exchanged can be a γ, Z or W±–boson with the in– and outgoing lepton, respectively, being an electron, muon or neutrino. In the following, we consider only unpolarized neutral current charged lepton–nucleon scattering. In addition, we will disregard weak gauge boson effects caused by the exchange of a Z–boson. This is justified as long as the virtuality is not too large, i.e. Q2 < 500 GeV2, cf. [186]. We assume the QED- and electroweak radiative corrections to have been carried out, [183,184,187]. The kinematic region of DIS is limited by a series of conditions. The hadronic mass obeys W 2 ≥M2 . (2.10) Furthermore, ν ≥ 0 , 0 ≤ y ≤ 1 , s ≥M2 . (2.11) From (2.10) follows the kinematic region for Bjorken-x via W 2 = (P + q)2 = M2 −Q2 ( 1− 1x ) ≥M2 =⇒ 0 ≤ x ≤ 1 . (2.12) Note that x = 1 describes the elastic process, while the inelastic region is defined by x < 1. Additional kinematic constraints follow from the design parameters of the accelerator, [188]. In the case of HERA, these were 820(920) GeV for the proton beam and 27.5 GeV for the electron beam, resulting in a cms–energy √s of 300.3(319) GeV 3. This additionally imposes kinematic constraints which follow from Q2 = xy(s−M2) , (2.13) correlating s and Q2. For the kinematics at HERA, this implies Q2 ≤ sx ≈ 105x . (2.14) 3During the final running period of HERA, low–energy measurements were carried out with Ep = 460 (575) GeV in order to extract the longitudinal structure function FL(x,Q2), [80]. 14 In order to calculate the cross section of deeply inelastic ep–scattering, one considers the tree–level transition matrix element for the electromagnetic current. It is given by, cf. e.g. [37,38,54], Mfi = e2u(l′, η′)γµu(l, η) 1 q2 〈PF | J em µ (0) | P, σ〉 . (2.15) Here, the spin of the charged lepton or nucleon is denoted by η(η′) and σ, respectively. The state vectors of the initial–state nucleons and the hadronic final state are | P, σ〉 and | PF 〉. The Dirac–matrices are denoted by γµ and bi–spinors by u, see Appendix A. Further e is the electric unit charge and Jemµ (ξ) the quarkonic part of the electromagnetic current operator, which is self-adjoint : J†µ(ξ) = Jµ(ξ) . (2.16) In QCD, it is given by Jemµ (ξ) = ∑ f,f ′ Ψf (ξ)γµλemff ′Ψf ′(ξ) , (2.17) where Ψf (ξ) denotes the quark field of flavor f . For three light flavors, λem is given by the following combination of Gell–Mann matrices of the flavor group SU(3)flavor, cf. [189,190], λem = 1 2 ( λ3flavor + 1√ 3 λ8flavor ) . (2.18) According to standard definitions, [37, 38, 54, 191], the differential inclusive cross section is then given by l′0 dσ d3l′ = 1 32(2π)3(l.P ) ∑ η′,η,σ,F (2π)4δ4(PF + l′ − P − l)|Mfi|2 . (2.19) Inserting the transition matrix element (2.15) into the relation for the scattering cross section (2.19), one notices that the trace over the leptonic states forms a separate tensor, Lµν . Similarly, the hadronic tensor Wµν is obtained, Lµν(l, l′) = ∑ η′,η [ u(l′, η′)γµu(l, η) ]∗[ u(l′, η′)γνu(l, η) ] , (2.20) Wµν(q, P ) = 1 4π ∑ σ,F (2π)4δ4(PF − q − P )〈P, σ | Jemµ (0) | PF 〉〈PF | Jemν (0) | P, σ〉 . (2.21) Thus one arrives at the following relation for the cross section l′0 dσ d3l′ = 1 4P.l α2 Q4L µνWµν = 1 2(s−M2) α2 Q4L µνWµν , (2.22) where α denotes the fine-structure constant, see Appendix A. The leptonic tensor in (2.22) can be easily computed in the context of the Standard Model, Lµν(l, l′) = Tr[l/γµl′/γν ] = 4 ( lµl′ν + l′µlν − Q2 2 gµν ) . (2.23) 15 This is not the case for the hadronic tensor, which contains non–perturbative hadronic con- tributions due to long-distance effects. To calculate these effects a priori, non-perturbative QCD calculations have to be performed, as in QCD lattice simulations. During the last years these calculations were performed with increasing systematic and numerical accu- racy, cf. e.g. [192,193]. The general structure of the hadronic tensor can be fixed using S–matrix theory and the global symmetries of the process. In order to obtain a form suitable for the subsequent calculations, one rewrites Eq. (2.21) as, cf. [38, 194], Wµν(q, P ) = 1 4π ∑ σ ∫ d4ξ exp(iqξ)〈P | [Jemµ (ξ), Jemν (0)] | P 〉 = 1 2π ∫ d4ξ exp(iqξ)〈P | [Jemµ (ξ), Jemν (0)] | P 〉 . (2.24) Here, the following notation for the spin-average is introduced in Eq. (2.24) 1 2 ∑ σ 〈P, σ | X | P, σ〉 ≡ 〈P | X | P 〉 . (2.25) Further, [a, b] denotes the commutator of a and b. Using symmetry and conservation laws, the hadronic tensor can be decomposed into different scalar structure functions and thus be stripped of its Lorentz–structure. In the most general case, including polarization, there are 14 independent structure functions, [195, 196], which contain all information on the structure of the proton. However, in the case considered here, only two structure functions contribute. One uses Lorentz– and time–reversal invariance, [42], and additionally the fact that the electromagnetic current is conserved. This enforces electromagnetic gauge invariance for the hadronic tensor, qµW µν = 0 . (2.26) The leptonic tensor (2.23) is symmetric and thus Wµν can be taken to be symmetric as well, since all antisymmetric parts are canceled in the contraction. By making a general ansatz for the hadronic tensor using these properties, one obtains Wµν(q, P ) = 1 2x ( gµν + qµqν Q2 ) FL(x,Q2) + 2x Q2 ( PµPν + qµPν + qνPµ 2x − Q2 4x2 gµν ) F2(x,Q2) . (2.27) The dimensionless structure functions F2(x,Q2) and FL(x,Q2) depend on two variables, Bjorken-x and Q2, contrary to the case of elastic scattering, in which only one variable, e.g. Q2, determines the cross section. Due to hermiticity of the hadronic tensor, the structure functions are real. The decomposition (2.27) of the hadronic tensor leads to the differential cross section of unpolarized DIS in case of single photon exchange dσ dxdy = 2πα2 xyQ2 {[ 1 + (1− y)2 ] F2(x,Q2)− y2FL(x,Q2) } . (2.28) A third structure function, F1(x,Q2), F1(x,Q2) = 1 2x [ F2(x,Q2)− FL(x,Q2) ] , (2.29) 16 which is often found in the literature, is not independent of the previous ones. For completeness, we finally give the full Born cross section for the neutral current, including the exchange of Z–bosons, cf. [184]. Not neglecting the lepton mass m, it is given by d2σNC dxdy = 2πα2 xyQ2 {[ 2 (1− y)− 2xyM 2 s + ( 1− 2m 2 Q2 )( 1 + 4x2M 2 Q2 ) × y 2 1 +R(x,Q2) ] F2(x,Q2) + xy(2− y)F3(x,Q2) } . (2.30) Here, R(x,Q2) denotes the ratio R(x,Q2) = σLσT = ( 1 + 4x2M 2 Q2 ) F2(x,Q2) 2xF1(x,Q2) − 1 , (2.31) and the effective structure functions Fl(x,Q2), l = 1...3 are represented by the structure functions Fl, Gl and Hl via F1,2(x,Q2) = F1,2(x,Q2) + 2|Qe| (ve + λae)χ(Q2)G1,2(x,Q2) + 4 ( v2e + a2e + 2λveae ) χ2(Q2)H1,2(x,Q2) , (2.32) xF3(x,Q2) = −2 sign(Qe) { |Qe| (ae + λve)χ(Q2)xG3(x,Q2) + [ 2veae + λ ( v2e + a2e )] χ2(Q2)xH3(x,Q2) } . (2.33) Here, Qe = −1, ae = 1 in case of electrons and λ = ξ sign(Qe) , (2.34) ve = 1− 4 sin2 θeffW , (2.35) χ(Q2) = Gµ√ 2 M2Z 8πα(Q2) Q2 Q2 +M2Z , (2.36) with ξ the electron polarization, θeffW the effective weak mixing angle, Gµ the Fermi constant and MZ the Z–boson mass. 2.2 The Parton Model The structure functions (2.27) depend on two kinematic variables, x and Q2. Based on an analysis using current algebra, Bjorken predicted scaling of the structure functions, cf. [17], lim {Q2, ν} → ∞, x=const. F(2,L)(x,Q2) = F(2,L)(x) . (2.37) This means that in the Bjorken limit {Q2, ν } → ∞, with x fixed, the structure functions depend on the ratio Q2/ν only. Soon after this prediction, approximate scaling was 17 observed experimentally in electron-proton collisions at SLAC (1968), [18], cf. also [19] 4. Similar to the α−particle scattering experiments by Rutherford in 1911, [197], the cross section remained large at high momentum transfer Q2, a behavior which is known from point–like targets. This was found in contradiction to the expectation that the cross section should decrease rapidly with increasing Q2, since the size of the proton had been determined to be about 10−13 cm with a smooth charge distribution, [198]. However, only in rare cases a single proton was detected in the final state, instead it consisted of a large number of hadrons. A proposal by Feynman contained the correct ansatz. To account for the observations, he introduced the parton model, [20,21], cf. also [22,26,37, 54, 181]. He assumed the proton as an extended object, consisting of several point-like particles, the partons. They are bound together by their mutual interaction and behave like free particles during the interaction with the highly virtual photon in the Bjorken- limit 5. One arrives at the picture of the proton being “frozen” while the scattering takes place. The electron scatters elastically off the partons and this process does not interfere with the other partonic states, the “spectators”. The DIS cross section is then given by the incoherent sum over the individual virtual electron–parton cross sections. Since no information on the particular proton structure is known, Feynman described parton i by the parton distribution function (PDF) fi(z). It gives the probability to find parton i in the “frozen” proton, carrying the fraction z of its momentum. Figure 2 shows a schematic picture of the parton model in Born approximation. The in– and outgoing parton momenta are denoted by p and p′, respectively. P p = zP l′ l p′ ︸ ︷︷ ︸ spectators Figure 2: Deeply inelastic electron-proton scattering in the parton model. Similar to the scaling variable x, one defines the partonic scaling variable τ , τ ≡ Q 2 2p.q . (2.38) It plays the same role as the Bjorken-variable, but for the partonic sub-process. In the 4The results obtained at DESY, [168], pointed in the same direction, but were less decisive, because not as large values of Q2 as at SLAC could be reached. 5Asymptotic freedom, which was discovered later, is instrumental for this property. 18 collinear parton model 6, which is applied throughout this thesis, p = zP holds, i.e., the momentum of the partons is taken to be collinear to the proton momentum. From (2.38) one obtains τz = x . (2.39) Feynman’s original parton model, referred to as the naive parton model, neglects the mass of the partons and enforces the strict correlation δ (q.p M − Q2 2M ) , (2.40) due to the experimentally observed scaling behavior, which leads to z = x. The naive parton model then assumes, in accordance with the quark hypothesis, [1,2,26], that the proton is made up of three valence quarks, two up and one down type, cf. e.g. [5]. This conclusion was generally accepted only several years after the introduction of the parton model, when various experiments had verified its predictions. Let us consider a simple example, which reproduces the naive parton model at LO and incorporates already some aspects of the improved parton model. The latter allows virtual quark states (sea-quarks) and gluons as partons as well. In the QCD–improved parton model, cf. [37,54,181], besides the δ-distribution, (2.40), a functionW iµν(τ,Q2) contributes to the hadronic tensor. It is called partonic tensor and given by the hadronic tensor, Eq. (2.24), replacing the hadronic states by partonic states i. The basic assumption is that the hadronic tensor can be factorized into the PDFs and the partonic tensor, cf. e.g. [51,203]. The PDFs are non-perturbative quantities and have to be extracted from experiment, whereas the partonic tensors are calculable perturbatively. A more detailed discussion of this using the LCE is given in Section 2.3. The hadronic tensor reads, cf. [56], Wµν(x,Q2) = 1 4π ∑ i ∫ 1 0 dz ∫ 1 0 dτ (fi(z) + fi(z))W iµν(τ,Q2)δ(x− zτ) . (2.41) Here, the number of partons and their respective type are not yet specified and we have included the corresponding PDF of the respective anti-parton, denoted by fi(z). Let us assume that the electromagnetic parton current takes the simple form 〈i | jiµ(τ) | i〉 = −ieiuiγµui , (2.42) similar to the leptonic current, (2.15). Here ei is the electric charge of parton i. At LO one finds W iµν(τ,Q2) = 2πe2i q.pi δ(1− τ) [ 2piµpiν + piµqν + piνqµ − gµνq.pi ] . (2.43) The δ-distribution in (2.43), together with the δ-distribution in (2.41), just reproduces Feynman’s assumption of the naive parton model, z = x. Substitution of (2.43) into the general expression for the hadronic tensor (2.27) and projecting onto the structure functions yields FL(x,Q2) = 0 , F2(x,Q2) = x ∑ i e2i (fi(x) + fi(x)) . (2.44) This result, at LO, is the same as in the naive parton model. It predicts 6For other parton models, as the covariant parton model, cf. [199–202]. 19 • the Callan-Gross relation, cf. [23], FL(x,Q2) = F2(x,Q2)− 2xF1(x,Q2) = 0 . (2.45) • the structure functions are scale-independent. These findings were a success of the parton model, since they reproduced the general behavior of the data as observed by the MIT/SLAC experiments. Finally, we present for completeness the remaining structure functions G2,3 and H2,3 at the Born level for the complete neutral current, cf. Eq. (2.30), G2(x,Q2) = x ∑ i |ei|vi (fi(x) + fi(x)) , (2.46) H2(x,Q2) = x ∑ i 1 4 ( v2i + a2i ) (fi(x) + fi(x)) , (2.47) xG3(x,Q2) = x ∑ i |ei|ai (fi(x)− fi(x)) , (2.48) xH3(x,Q2) = x ∑ i 1 2 viai (fi(x)− fi(x)) , (2.49) with ai = 1 and vi = 1− 4|ei| sin2 θeffW . (2.50) 2.2.1 Validity of the Parton Model The validity of the parton picture can be justified by considering an impulse approximation of the scattering process as seen from a certain class of reference frames, in which the proton momentum is taken to be very large (P∞-frames). Two things happen to the proton when combining this limit with the Bjorken–limit: The internal interactions of its partons are time dilated, and it is Lorentz contracted in the direction of the collision. As the cms energy increases, the parton lifetimes are lengthened and the time it takes the electron to interact with the proton is shortened. Therefore the condition for the validity of the parton model is given by, cf. [26, 204], τint τlife ≪ 1 . (2.51) Here τint denotes the interaction time and τlife the average life time of a parton. If (2.51) holds, the proton will be in a single virtual state characterized by a certain number of partons during the entire interaction time. This justifies the assumption that parton i carries a definite momentum fraction zi, 0 ≤ zi ≤ 1, of the proton in the cms. This parton model is also referred to as collinear parton model, since the proton is assumed to consist out of a stream of partons with parallel momenta. Further ∑ i zi = 1 holds. In order to derive the fraction of times in (2.51), one aligns the coordinate system parallel to the proton’s momentum. Thus one obtains in the limit P 23 ≫M2, [205], P = (√ P 23 +M2; 0, 0, P3 ) ≈ ( P3 + M2 2 · P3 ; 0, 0, P3 ) . (2.52) 20 The photon momentum can be parametrized by q = (q0; q3, ~q⊥) , (2.53) where ~q⊥ denotes its transverse momentum with respect to the proton. By choosing the cms of the initial states as reference and requiring that νM and q2 approach a limit independent of P3 as P3 →∞, one finds for the characteristic interaction time scale, using an (approximate) time–energy uncertainty relation, τint ≃ 1 q0 = 4P3x Q2(1− x) . (2.54) The life time of the individual partons is estimated accordingly to be inversely proportional to the energy fluctuations of the partons around the average energy E τlife ≃ 1∑ i Ei − E . (2.55) Here Ei denote the energies of the individual partons. After introducing the two- momentum ~k⊥i of the partons perpendicular to the direction of motion of the proton as given in (2.52), a simple calculation yields, cf. [205], τint τlife = 2x Q2(1− x) ( ∑ i (m2i + k2⊥i) zi −M2 ) , (2.56) where mi denotes the mass of the i-th parton. This expression is independent of P3. The above procedure allows therefore to estimate the probability of deeply inelastic scattering to occur independently of the large momentum of the proton. Accordingly, we consider now the case of two partons with momentum fractions x and 1−x and equal perpendicular momentum, neglecting all masses. One obtains τint τlife ≈ 2k 2 ⊥ Q2(1− x)2 . (2.57) This example leads to the conclusion, that deeply inelastic scattering probes single partons if the virtuality of the photon is much larger than the transverse momenta squared of the partons and Bjorken-x is neither close to one nor zero. In the latter case, xP3 would be the large momentum to be considered. If one does not neglect the quark masses, one has to adjust this picture, as will be described in Section 3.3. 2.3 The Light–Cone Expansion In quantum field theory one usually considers time-ordered products, denoted by T, rather than a commutator as it appears in the hadronic tensor in Eq. (2.24). The hadronic tensor can be expressed as the imaginary part of the forward Compton amplitude for virtual gauge boson–nucleon scattering, Tµν(q, P ). The optical theorem, depicted graphically in Figure 3, yields Wµν(q, P ) = 1 π Im Tµν(q, P ) , (2.58) 21 where the Compton amplitude is given by, cf. [189], Tµν(q, P ) = i ∫ d4ξ exp(iqξ)〈P | TJµ(ξ)Jν(0) | P 〉 . (2.59) ∑ F F 2 = 1π Im Figure 3: Schematic picture of the optical theorem. By applying the same invariance and conservation conditions as for the hadronic ten- sor, the Compton amplitude can be expressed in the unpolarized case by two amplitudes TL(x,Q2) and T2(x,Q2). It is then given by Tµν(q, P ) = 1 2x ( gµν + qµqν Q2 ) TL(x,Q2) + 2x Q2 ( PµPν + qµPν + qνPµ 2x − Q2 4x2 gµν ) T2(x,Q2) . (2.60) Using translation invariance, one can show that (2.59) is crossing symmetric under q → −q, cf. [195,206], Tµν(q, P ) = Tµν(−q, P ) , (2.61) with q → −q being equivalent to ν, x→ (−ν), (−x). The corresponding relations for the amplitudes are then obtained by considering (2.60) T(2,L)(x,Q2) = T(2,L)(−x,Q2) . (2.62) By (2.58) these amplitudes relate to the structure functions FL and F2 as F(2,L)(x,Q2) = 1 π Im T(2,L)(x,Q 2) . (2.63) Another general property of the Compton amplitude is that TL and T2 are real analytic functions of x at fixed Q2, cf. [50], i.e. T(2,L)(x∗, Q2) = T ∗(2,L)(x,Q2) . (2.64) Using this description one can perform the LCE, [42], or the cut–vertex method in the time–like case, [207–209], respectively, and derive general properties of the moments of the structure functions as will be shown in the subsequent Section. A technical aspect 22 which has been proved very useful is to work in Mellin space rather than in x–space. The Nth Mellin moment of a function f is defined through the integral M[f ](N) ≡ ∫ 1 0 dz zN−1f(z) . (2.65) This transform diagonalizes the Mellin–convolution f ⊗ g of two functions f, g [f ⊗ g](z) = ∫ 1 0 dz1 ∫ 1 0 dz2 δ(z − z1z2) f(z1)g(z2) . (2.66) The convolution (2.66) decomposes into a simple product of the Mellin-transforms of the two functions, M[f ⊗ g](N) = M[f ](N)M[g](N) . (2.67) In Eqs. (2.65, 2.67), N is taken to be an integer. However, later on one may perform an analytic continuation to arbitrary complex values of N , [210]. Note that it is enough to know all even or odd integer moments – as is the case for inclusive DIS – of the functions f, g to perform an analytic continuation to arbitrary complex values N ∈ C, [211]. Then Eq. (2.66) can be obtained from the relation for the moments, (2.67), by an inverse Mellin– transform. Hence in this case the z– and N–space description are equivalent, which we will frequently use later on. 2.3.1 Light–Cone Dominance It can be shown that in the Bjorken limit, Q2 →∞, ν →∞, x fixed, the hadronic tensor is dominated by its contribution near the light–cone, i.e. by the values of the integrand in (2.24) at ξ2 ≈ 0, cf. [42]. This can be understood by considering the infinite momentum frame, see Section 2.2.1, P = (P3; 0, 0, P3) , (2.68) q = ( ν 2P3 ; √ Q2, 0, −ν 2P3 ) , (2.69) P3 ≈ √ ν →∞ . (2.70) According to the Riemann–Lebesgue theorem, the integral in (2.24) is dominated by the region where q.ξ ≈ 0 due to the rapidly oscillating exponential exp(iq.ξ), [37]. One can now rewrite the dot product as, cf. [190], q.ξ = 1 2 (q0 − q3)(ξ0 + ξ3) + 1 2 (q0 + q3)(ξ0 − ξ3)− q1ξ1 , (2.71) and infer that the condition q.ξ ≈ 0 in the Bjorken-limit is equivalent to ξ0 ± ξ3 ∝ 1√ν , ξ 1 ∝ 1√ν , (2.72) which results in ξ2 ≈ 0 , (2.73) 23 called light–cone dominance: for DIS in the Bjorken-limit the dominant contribution to the hadronic tensor Wµν(q, P ) and the Compton Amplitude comes from the region where ξ2 ≈ 0. This property allows to apply the LCE of the current–current correlation in Eq. (2.24) and for the time ordered product in Eq. (2.59), respectively. In the latter case it reads for scalar currents, cf. [42], lim ξ2→0 TJ(ξ), J(0) ∝ ∑ i,N,τ CNi,τ (ξ2, µ2)ξµ1 ...ξµNOµ1...µNi,τ (0, µ2) . (2.74) The Oi,τ (ξ, µ2) are local operators which are finite as ξ2 → 0. The singularities which appear for the product of two operators as their arguments become equal are shifted to the c-number coefficients CNi,τ (ξ2, µ2), the Wilson coefficients, and can therefore be treated separately. In Eq. (2.74), µ2 is the factorization scale describing at which point the separation between the perturbative and non–perturbative contributions takes place. The summation index i runs over the set of allowed operators in the model, while the sum over N extends to infinity. Dimensional analysis shows that the degree of divergence of the functions CNi,τ as ξ2 → 0 is given by CNi,τ (ξ2, µ2) ∝ ( 1 ξ2 )−τ/2+dJ . (2.75) Here, dJ denotes the canonical dimension of the current J(ξ) and τ is the twist of the local operator Oµ1..µNi,τ (ξ, µ2), which is defined by, cf. [43], τ ≡ DO −N . (2.76) DO is the canonical (mass) dimension of Oµ1..µNi,τ (ξ, µ2) and N is called its spin. From (2.75) one can infer that the most singular coefficients are those related to the operators of lowest twist, i.e. in the case of the LCE of the electromagnetic current (2.17), twist τ = 2. The contributions due to higher twist operators are suppressed by factors of (µ2/Q2)k, with µ a typical hadronic mass scale of O(1 GeV). In a wide range of phase– space it is thus sufficient to consider the leading twist contributions only, which we will do in the following and omit the index τ . 2.3.2 A Simple Example In this Section, we consider a simple example of the LCE applied to the Compton am- plitude and its relation to the hadronic tensor, neglecting all Lorentz–indices and model dependence, cf. Ref. [38, 106]. The generalization to the case of QCD is straightforward and hence we will already make some physical arguments which apply in both cases. The scalar expressions corresponding to the hadronic tensor and the Compton amplitude are given by W (x,Q2) = 1 2π ∫ d4ξ exp(iqξ)〈P | [J(ξ), J(0)] | P 〉 , (2.77) T (x,Q2) = i ∫ d4ξ exp(iqξ)〈P | TJ(ξ)J(0) | P 〉 . (2.78) 24 Eq. (2.78) can be evaluated in the limit ξ2 → 0 for twist τ = 2 by using the LCE given in Eq. (2.74), where for brevity only one local operator is considered. The coefficient functions in momentum space are defined as ∫ exp(iq.ξ)ξµ1 ..ξµNC N (ξ2, µ2) ≡ −i ( 2 −q2 )N qµ1 ...qµNCN (Q2 µ2 ) . (2.79) The nucleon states act on the composite operators only and the corresponding matrix elements can be expressed as 〈P | Oµ1...µN (0, µ2) | P 〉 = AN (P 2 µ2 ) P µ1 ...P µN + trace terms. (2.80) The trace terms in the above equation can be neglected, because due to dimensional counting they would give contributions of the order 1/Q2, 1/ν and hence are irrelevant in the Bjorken–limit. Thus the Compton amplitude reads, cf. e.g. [38,54], T (x′, Q2) = 2 ∑ N=0,2,4,.. CN (Q2 µ2 ) AN (P 2 µ2 ) x′N , x′ = 1x (2.81) In (2.81) only the even moments contribute. This is a consequence of crossing symmetry, Eq. (2.62), and holds as well in the general case of unpolarized DIS for single photon exchange. In other cases the projection is onto the odd moments. Depending on the type of the observable the series may start at different initial values, cf. e.g. [195,196]. The sum in Eq. (2.81) is convergent in the unphysical region x ≥ 1 and an analytic continuation to the physical region 0 ≤ x ≤ 1 has to be performed. Here, one of the assumptions is that scattering amplitudes are analytic in the complex plane except at values of kinematic variables allowing intermediate states to be on mass–shell. This general feature has been proved to all orders in perturbation theory, [212,213]. In QCD, it is justified on grounds of the parton model. When ν ≥ Q2/2M , i.e. 0 ≤ x ≤ 1, the virtual photon-proton system can produce a physical hadronic intermediate state, so the T(2,L)(x,Q2) and T (x,Q2), respectively, have cuts along the positive (negative) real x-axis starting from 1(−1) and poles at ν = Q2/2M (x = 1,−1). The discontinuity along the cut is then just given by (2.58). The Compton amplitude can be further analyzed by applying (subtracted) dispersion relations, cf. [195, 196]. Equivalently, one can divide both sides of Eq. (2.81) by x′m and integrate along the path shown in Figure 4, cf. [38, 56]. 1−1 Figure 4: Integration contour in the complex x′-plane. 25 For the left–hand side of (2.81) one obtains 1 2πi ∮ dx′T (x ′, Q2) x′m = 2 π ∫ ∞ 1 dx′ x′m ImT (x ′, Q2) = 2 ∫ 1 0 dx xm−2W (x,Q2) , (2.82) where the optical theorem, (2.58), and crossing symmetry, (2.62) have been used. The right–hand side of (2.81) yields 1 πi ∑ N=0,2,4,.. CN (Q2 µ2 ) AN (P 2 µ2 )∮ dx′ x′N−m = 2Cm−1 (Q2 µ2 ) Am−1 (P 2 µ2 ) . (2.83) Thus from Eqs. (2.82) and (2.83) one obtains for the moments of the scalar hadronic tensor defined in Eq. (2.77) ∫ 1 0 dx xN−1W (x,Q2) = CN (Q2 µ2 ) AN (P 2 µ2 ) . (2.84) 2.3.3 The Light–Cone Expansion applied to DIS In order to derive the moment–decomposition of the structure functions one essentially has to go through the same steps as in the previous Section. The LCE of the physical forward Compton amplitude (2.59) at the level of twist τ = 2 in the Bjorken–limit is given by, cf. [48, 106], Tµν(q, P ) → ∑ i,N { [ Q2gµµ1gνµ2 + gµµ1qνqµ2 + gνµ2qµqµ1 − gµνqµ1qµ2 ] Ci,2 ( N, Q 2 µ2 ) + [ gµν + qµqµ Q2 ] qµ1qµ2Ci,L ( N, Q 2 µ2 )} qµ3 ...qµN ( 2 Q2 )N 〈P | Oµ1...µNi (µ2) | P 〉 . (2.85) Additionally to Section 2.3.2, the index i runs over the allowed operators which emerge from the expansion of the product of two electromagnetic currents, Eq. (2.17). The possible twist–2 operators are given by 7, [208], ONSq,r;µ1,... ,µN = i N−1S[ψγµ1Dµ2 . . . DµN λr 2 ψ]− trace terms , (2.86) OSq;µ1,... ,µN = i N−1S[ψγµ1Dµ2 . . . DµNψ]− trace terms , (2.87) OSg;µ1,... ,µN = 2i N−2SSp[F aµ1αDµ2 . . . DµN−1F α,a µN ]− trace terms . (2.88) Here, S denotes the symmetrization operator of the Lorentz indices µ1, . . . , µN . λr is the flavor matrix of SU(nf ) with nf light flavors, ψ denotes the quark field, F aµν the gluon field–strength tensor, and Dµ the covariant derivative. The indices q, g represent the quark– and gluon–operator, respectively. Sp in (2.88) is the color–trace and a the color index in the adjoint representation, cf. Appendix A. The quark–fields carry color indices in the fundamental representation, which have been suppressed. The classification of the 7Here we consider only the spin–averaged case for single photon exchange. Other operators contribute for parity–violating processes, in the polarized case and for transversity, cf. Sections 8 and 9. 26 composite operators (2.86–2.88) in terms of flavor singlet (S) and non-singlet (NS) refers to their symmetry properties with respect to the flavor group SU(nf ). The operator in Eq. (2.86) belongs to the adjoint representation of SU(nf ), whereas the operators in Eqs. (2.87, 2.88) are singlets under SU(nf ). Neglecting the trace terms, one rewrites the matrix element of the composite operators in terms of its Lorentz structure and the scalar operator matrix elements, cf. [54, 190], 〈P | Oµ1...µNi | P 〉 = Ai ( N, P 2 µ2 ) P µ1 ...P µN . (2.89) Eq. (2.85) then becomes Tµν(q, P ) = 2 ∑ i,N { 2x Q2 [ PµPν + Pµqν + Pνqµ 2x − Q2 4x2 gµν ] Ci,2 ( N, Q 2 µ2 ) + 1 2x [ gµν + qµqµ Q2 ] Ci,L ( N, Q 2 µ2 )} 1 xN−1Ai ( N, P 2 µ2 ) . (2.90) Comparing Eq. (2.90) with the general Lorentz structure expected for the Compton ampli- tude, Eq. (2.60), the relations of the scalar forward amplitudes to the Wilson coefficients and nucleon matrix elements can be read off T(2,L)(x,Q2) = 2 ∑ i,N 1 xN−1Ci,(2,L) ( N, Q 2 µ2 ) Ai ( N, P 2 µ2 ) . (2.91) Eq. (2.91) is of the same type as Eq. (2.81) and one thus obtains for the moments of the structure functions F(2,L)(N,Q2) = M[F(2,L)(x,Q2)](N) (2.92) = ∑ i Ci,(2,L) (Q2 µ2 , N ) Ai (P 2 µ2 , N ) . (2.93) The above equations have already been written in Mellin space, which we will always do from now on, if not indicated otherwise. Eqs. (2.91, 2.93), together with the general struc- ture of the Compton amplitude, Eqs. (2.60, 2.90), and the hadronic tensor, Eq. (2.27), are the basic equations for theoretical or phenomenological analysis of DIS in the kinematic regions where higher twist effects can be safely disregarded. Note that the generalization of these equations to electroweak or polarized interactions is straightforward by includ- ing additional operators and Wilson coefficients. In order to interpret Eqs. (2.91, 2.93), one uses the fact that the Wilson coefficients Ci,(2,L) are independent of the proton state. This is obvious since the wave function of the proton only enters into the definition of the operator matrix elements, cf. Eq. (2.89). In order to calculate the Wilson coefficients, the proton state has therefore to be replaced by a suitably chosen quark or gluon state i with momentum p. The corresponding partonic tensor is denoted byW iµν(q, p), cf. below Eq. (2.40), with scalar amplitudes F i(2,L)(τ,Q2). Here τ is the partonic scaling variable defined in Eq. (2.38). The LCE of the electromagnetic current does not change and the replacement only affects the operator matrix elements. The forward Compton amplitude for photon–quark (gluon) scattering corresponding to W iµν(q, p) can be calculated order 27 by order in perturbation theory, provided the scale Q2 is large enough for the strong coupling constant to be small. In the same manner, the contributing operator matrix elements with external partons may be evaluated. Finally, one can read off the Wilson coefficients from the partonic equivalent of Eq. (2.91) 8. By identifying the nucleon OMEs (2.89) with the PDFs, one obtains the QCD improved parton model. At LO it coincides with the naive parton model, which we described in Section 2.2, as can be inferred from the discussion below Eq. (2.41). The improved parton model states that in the Bjorken limit at the level of twist τ = 2 the unpolarized nucleon structure functions Fi(x,Q2) are obtained in Mellin space as products of the universal parton densities fi(N,µ2) with process–dependent Wilson coefficients Ci,(2,L)(N,Q2/µ2) F(2,L)(N,Q2) = ∑ i Ci,(2,L) ( N, Q 2 µ2 ) fi(N,µ2) (2.94) to all orders in perturbation theory. This property is also formulated in the factorization theorems, [203], cf. also [51], where it is essential that an inclusive, infrared–safe cross sec- tion is considered, [214]. We have not yet dealt with the question of how renormalization is being performed. However, we have already introduced the scale µ2 into the right–hand side of Eq. (2.94). This scale is called factorization scale. It describes a mass scale at which the separation of the structure functions into the perturbative hard scattering coef- ficients Ci,(2,L) and the non–perturbative parton densities fi can be performed. This choice is arbitrary at large enough scales and the physical structure functions do not depend on it. This independence is used in turn to establish the corresponding renormalization group equation, [215,216], which describes the scale–evolution of the Wilson coefficients, parton densities and structure functions w.r.t. to µ2 and Q2, cf. Refs. [37, 48, 54, 217–219] and Section 2.4. These evolution equations then predict scaling violations and are used to analyze experimental data in order to unfold the twist–2 parton distributions at some scale Q20, together with the QCD–scale ΛQCD, cf. [217,220,221]. Before finishing this Section, we describe the quantities appearing in Eq. (2.94) in detail. Starting from the operators defined in Eqs. (2.86)–(2.88), three types of parton densities are expected. Since the question how heavy quarks are treated in this framework will be discussed in Section 3, we write the following equations for nf light flavors in massless QCD. The gluon density is denoted by G(nf , N, µ2) and multiplies the gluonic Wilson coefficients Cg,(2,L)(nf , N,Q2/µ2), which describe the interaction of a gluon with a photon and emerge for the first time at O(αs). Each quark and its anti–quark have a parton density, denoted by fk(k)(nf , N, µ2). These are grouped together into the flavor singlet combination Σ(nf , N, µ2) and a non–singlet combination ∆k(nf , N, µ2) as follows Σ(nf , N, µ2) = nf∑ l=1 [ fl(nf , N, µ2) + fl¯(nf , N, µ2) ] , (2.95) ∆k(nf , N, µ2) = fk(nf , N, µ2) + fk¯(nf , N, µ2)− 1 nf Σ(nf , N, µ2) . (2.96) 8Due to the optical theorem, one may also obtain the Wilson coefficients by calculating the inclusive hard scattering cross sections of a virtual photon with a quark(gluon) using the standard Feynman–rules and phase–space kinematics. 28 The distributions multiply the quarkonic Wilson coefficients CS,NSq,(2,L)(nf , N,Q2/µ2), which describe the hard scattering of a photon with a light quark. The complete factorization formula for the structure functions is then given by F(2,L)(nf , N,Q2) = 1 nf nf∑ k=1 e2k [ Σ(nf , N, µ2)CSq,(2,L) ( nf , N, Q2 µ2 ) + G(nf , N, µ2)CSg,(2,L) ( nf , N, Q2 µ2 ) + nf∆k(nf , N, µ2)CNSq,(2,L) ( nf , N, Q2 µ2 )] . (2.97) Note, that one usually splits the quarkonic S contributions into a NS and pure–singlet (PS) part via S = PS + NS. The perturbative expansions of the Wilson coefficients read CSg,(2,L) ( nf , N, Q2 µ2 ) = ∞∑ i=1 aisC (i),S g,(2,L) ( nf , N, Q2 µ2 ) , (2.98) CPSq,(2,L) ( nf , N, Q2 µ2 ) = ∞∑ i=2 aisC (i),PS q,(2,L) ( nf , N, Q2 µ2 ) , (2.99) CNSq,(2,L) ( nf , N, Q2 µ2 ) = δ2 + ∞∑ i=1 aisC (i),NS q,(2,L) ( nf , N, Q2 µ2 ) , (2.100) where as ≡ αs/(4π) and δ2 = 1 for F2 and δ2 = 0 for FL . (2.101) These terms are at present known up to O(a3s). The O(as) terms have been calculated in Refs. [105–107] and the O(a2s) contributions by various groups in Refs. [108,109]. The O(a3s) terms have first been calculated for fixed moments in Refs. [110–112, 114] and the complete result for all N has been obtained in Refs. [115] 9. 2.4 RGE–improved Parton Model and Anomalous Dimensions In the following, we present a derivation of the RGEs for the Wilson coefficients, and subsequently, the evolution equations for the parton densities. When calculating scat- tering cross sections in quantum field theories, they usually contain divergences of dif- ferent origin. The infrared and collinear singularities are connected to the limit of soft– and collinear radiation, respectively. Due to the Bloch–Nordsieck theorem, [223], it is known that the infrared divergences cancel between virtual and bremsstrahlung contribu- tions. The structure functions are inclusive quantities. Therefore, all final state collinear (mass) singularities cancel as well, which is formulated in the Lee–Kinoshita–Nauenberg theorem, [224]. Thus in case of the Wilson coefficients, only the initial state collinear divergences of the external light partons and the ultraviolet divergences remain. The 9Recently, the O(a3s) Wilson coefficient for the structure function xF3(x,Q 2) was calculated in Ref. [222]. 29 latter are connected to the large scale behavior and are renormalized by a redefinition of the parameters of the theory, as the coupling constant, the masses, the fields, and the composite operators, [225, 226]. This introduces a renormalization scale µr, which forms the subtraction point for renormalization. The scale which appears in the factorization formulas (2.94, 2.97) is denoted by µf and called factorization scale, cf. [51, 203]. Its origin lies in the arbitrariness of the point at which short– and long–distance effects are separated and is connected to the redefinition of the bare parton densities by absorbing the initial state collinear singularities of the Wilson coefficients into them. Note, that one usually adopts dimensional regularization to regularize the infinities in perturbative calculations, cf. Section 4, which causes another scale µ to appear. It is associated to the mass dimension of the coupling constant in D 6= 4 dimensions. In principle all these three scales have to be treated separately, but we will set them equal in the subsequent analysis, µ = µr = µf . The renormalization group equations are obtained using the argument that all these scales are arbitrary and therefore physical quantities do not alter when changing these scales, [215,216,225,226]. One therefore defines the total derivative w.r.t. to µ2 D(µ2) ≡ µ2 ∂∂µ2 + β(as(µ 2)) ∂ ∂as(µ2) − γm(as(µ2))m(µ2) ∂ ∂m(µ2) . (2.102) Here the β–function and the anomalous dimension of the mass, γm, are given by β(as(µ2)) ≡ µ2 ∂as(µ2) ∂µ2 , (2.103) γm(as(µ2))) ≡ − µ2 m(µ2) ∂m(µ2) ∂µ2 , (2.104) cf. Sections 4.3, 4.4. The derivatives have to be performed keeping the bare quantities aˆs, mˆ fixed. Additionally, we work in Feynman–gauge and therefore the gauge–parameter is not present in Eq. (2.102). In the following we will consider only one mass m. The composite operators (2.86)–(2.88) are renormalized introducing operator Z–factors ONSq,r;µ1,...,µN = Z NS(µ2)OˆNSq,r;µ1,...,µN , (2.105) OSi;µ1,...,µN = Z S ij(µ2)OˆSj;µ1,...,µN , i = q, g , (2.106) where in the singlet case mixing occurs since these operators carry the same quantum numbers. The anomalous dimensions of the operators are defined by γNSqq = µZ−1,NS(µ2) ∂ ∂µZ NS(µ2) , (2.107) γSij = µZ−1,Sil (µ2) ∂ ∂µZ S lj(µ2) . (2.108) We begin by considering the partonic structure functions calculated with external fields l. Here we would like to point out that we calculate matrix elements of currents, operators, etc. and not vacuum expectation values of time–ordered products with the external fields included. The anomalous dimensions of the latter therefore do not contribute, [190], and they are parts of the anomalous dimensions of the composite operators, respectively. The RGE reads D(µ2)F l(2,L)(N,Q2) = 0 . (2.109) 30 On the partonic level, Eq. (2.93) takes the form F l(2,L)(N,Q2) = ∑ j Cj,(2,L) ( N, Q 2 µ2 ) 〈l | Oj(µ2) | l〉 . (2.110) From the operator renormalization constants of the Oi, Eqs. (2.105, 2.106), the following RGE is derived for the matrix elements, [48], ∑ j ( D(µ2) δij + 1 2 γS,NSij ) 〈l | Oj(µ2) | l〉 = 0 , (2.111) where we write the S and NS case in one equation for brevity and we remind the reader that in the latter case, i, j, l = q only. Combining Eqs. (2.109, 2.110, 2.111), one can determine the RGE for the Wilson coefficients. It reads ∑ i ( D(µ2) δij − 1 2 γS,NSij ) Ci,(2,L) ( N, Q 2 µ2 ) = 0 . (2.112) The structure functions, which are observables, obey the same RGE as on the partonic level D(µ2)F(2,L)(N,Q2) = µ2 d dµ2F(2,L)(N,Q 2) = 0 . (2.113) Using the factorization of the structure functions into Wilson coefficients and parton densities, Eqs. (2.94, 2.97), together with the RGE derived for the Wilson coefficients in Eq. (2.112), one obtains from the above formula the QCD evolution equations for the parton densities, cf. e.g. [37,48,54,217–219], d d lnµ2f S,NS i (nf , N, µ2) = − 1 2 ∑ j γS,NSij fS,NSj (nf , N, µ2) . (2.114) Eq. (2.114) describes the change of the parton densities w.r.t. the scale µ. In the more familiar matrix notation, these equations read d d lnµ2 ( Σ(nf , N, µ2) G(nf , N, µ2) ) = −1 2 ( γqq γqg γgq γgg )( Σ(nf , N, µ2) G(nf , N, µ2) ) , (2.115) d d lnµ2∆k(nf , N, µ 2) = −1 2 γNSqq ∆k(nf , N, µ2) , (2.116) where we have used the definition for the parton densities in Eqs. (2.95, 2.96). The anoma- lous dimensions in the above equations can be calculated order by order in perturbation theory. At LO, [46], and NLO, [119–123], they have been known for a long time. The NNLO anomalous dimension were calculated first for fixed moments in Refs. [111,112,114] and the complete result for all moments has been obtained in Refs. [124, 125] 10. As de- scribed, the PDFs are non–perturbative quantities and have to be extracted at a certain scale from experimental data using the factorization relation (2.94). If the scale µ2 is large enough to apply perturbation theory, the evolution equations can be used to calculate the 10Note that from our convention in Eqs. (2.107, 2.108) follows a relative factor 2 between the anomalous dimensions considered in this work compared to Refs. [124,125]. 31 PDFs at another perturbative scale, which provides a detailed QCD test comparing to precision data. There are similar evolution equations for the structure functions and Wil- son coefficients, cf. e.g. [37, 48, 54, 217–219]. Different groups analyze the evolution of the parton distribution functions based on precision data from deep–inelastic scattering experiments and other hard scattering cross sections. Analyzes were performed by the Dortmund group, [96,102,227–233], by Alekhin et. al., [97,234], Blu¨mlein et. al., [93,98], the MSTW–, [235], QTEQ–, [236], and the NNPDF–collaborations, [237]. The PDFs de- termined in this way can e.g. be used as input data for the pp collisions at the LHC, since they are universal quantities and only relate to the structure of the proton and not to the particular kind of scattering events considered. Apart from performing precision analyzes of the PDFs, one can also use the evolution equations to determine as more precisely, [93,96–98,102,232–235]. The evolution equations (2.114, 2.115, 2.116) are written for moments only. The representation in x–space is obtained by using (2.65, 2.66, 2.67) and is usually expressed in terms of the splitting functions Pij(x), [117]. At the level of twist–2 the latter are connected to the anomalous dimensions by the Mellin–transform γij(N) = −M[Pij](N) . (2.117) The behavior of parton distribution functions in the small x region attracted special inter- est due to possibly new dynamical contributions, such as Glauber–model based screening corrections, [238], and the so-called BFKL contributions, a ‘leading singularity’ resum- mation in the anomalous dimensions for all orders in the strong coupling constant, [239]. For both effects there is no evidence yet in the data both for F2(x,Q2) and FL(x,Q2), beyond the known perturbative contributions to O(a3s). This does not exclude that at even smaller values of x contributions of this kind will be found. The BFKL contributions were investigated on the basis of a consistent renormalization group treatment, together with the fixed order contributions in Refs. [240, 241]. One main characteristic, compar- ing with the fixed order case, is that several sub-leading series, which are unknown, are required to stabilize the results, see also [242]. This aspect also has to be studied within the framework of recent approaches, [243]. 32 3 Heavy Quark Production in DIS In the Standard Model, the charm, bottom and top quark are treated as heavy quarks, all of which have a mass larger than the QCD–scale ΛQCD(nf = 4) ≈ 240 MeV, [93, 96–98, 232, 233, 244]. The up, down and strange quark are usually treated as massless. Because of confinement, the quarks can only be observed via the asymptotic states baryons and mesons, in which they are contained. In the following, we concentrate on the inclusive production of one species of a heavy quark, denoted by Q(Q), with mass m. In the case of HERA kinematics, Q = c. This is justified to a certain extent by the observation that bottom quark contributions to DIS structure functions are much smaller, cf. [86] 11. Since the ratio m2c/m2b ≈ 1/10 is not small, there are regions in which both masses are potentially important. The description of these effects is beyond the scope of the formalism outlined below and of comparable order as the m2c/Q2 corrections. Top–quark production in l±N scattering is usually treated as a semi–inclusive process, cf. [246,247]. Charmed mesons are more abundantly produced at HERA than baryons. D–mesons are bound states of charm and lighter quarks, e.g. Du = uc, Dd = dc etc. Furthermore also cc resonances contribute, such as J/Ψ, by the observation of which charm was dis- covered, [57, 58]. The charm contributions to the structure functions are determined in experiment by tagging charm quarks in the final state, e.g. through the D–meson decay channel D∗ → D0πs → Kππs. In the case of DIS, the measured visible cross section is then extrapolated to the full inclusive phase space using theoretical models if structure functions are considered, [86,91,248–250]. Within the approach of this thesis, the main objective for studying heavy quark pro- duction in DIS is to provide a framework allowing for more precise measurements of as and of the parton densities and for a better description of the structure functions F cc2 , F bb2 . The current world data for the nucleon structure functions F p,d2 (x,Q2) reached the precision of a few per cent over a wide kinematic region. Both the measurements of the heavy flavor contributions to the deep-inelastic structure functions, cf. [85, 86, 249], and numerical studies, [89, 251, 252], based on the leading, [101, 102], and next-to-leading or- der heavy flavor Wilson coefficients, [103], show that the scaling violations of the light and the heavy contributions to (2.97) exhibit a different behavior over a wide range of Q2. This is both due to the logarithmic contributions lnk(Q2/m2) and power corrections ∝ (m2/Q2)k, k ≥ 1. Moreover, in the region of smaller values of x the heavy flavor contri- butions amount to 20–40%. Therefore, the precision measurement of the QCD parameter ΛQCD, [92,93,96–99,102,232,233,244], and of the parton distribution functions in deeply inelastic scattering requires the analysis at the level of the O(a3s) corrections to control the theory-errors at the level of the experimental accuracy and below, [92,96–99]. The precise value of ΛQCD, a fundamental parameter of the Standard Model, is of central importance for the quantitative understanding of all strongly interacting processes. Moreover, the possible unification of the gauge forces, [253], depends crucially on its value. In recent non–singlet analyzes, [93, 96, 98], errors for as(M2Z) of O(1.5 %) were obtained, partially extending the analysis effectively to N3LO. In the flavor singlet case the so far unknown 3–loop heavy flavor Wilson coefficients do yet prevent a consistent 3–loop analysis, [94, 95, 100]. Due to the large statistics in the lower x region, one may hope to eventually improve the accuracy of as(M2Z) beyond the above value. 11Likewise, for even higher scales the b–quark could be considered as the heavy quark with u, d, s, c being effectively massless, cf. e.g. [245]. 33 Of similar importance is the detailed knowledge of the PDFs for all hadron-induced processes, notably for the interpretation of all scattering cross sections measured at the TEVATRON and the LHC. For example, the process of Higgs-boson production at the LHC, cf. e.g. [254], depends on the gluon density and its accuracy is widely determined by this distribution. In Section 3.1, we describe the general framework of electroproduction of heavy quarks in DIS within the fixed–flavor–number–scheme (FFNS), treating only the light quarks and the gluon as constituents of the nucleon. In the following Section, 3.2, we out- line the method, which we use to extract all but the power suppressed contributions ∝ (m2/Q2)k, k ≥ 1 of the heavy flavor Wilson coefficients, [126]. The latter are equiva- lent to the Wilson coefficients introduced in Section 2.3.3, including heavy quarks. Finally, in Section 3.3 we comment on the possibility to define heavy quark parton densities within a variable–flavor–number–scheme (VFNS), [129]. 3.1 Electroproduction of Heavy Quarks We study electroproduction of heavy quarks in unpolarized DIS via single photon ex- change, cf. [101, 102, 255], at sufficiently large virtualities Q2, Q2 ≥ 5GeV 12. Here, one can distinguish two possible production mechanisms for heavy quarks: extrinsic produc- tion and intrinsic heavy quark excitation. In the latter case, one introduces a heavy quark state in the nucleon wave function, i.e. the heavy quark is treated at the same level as the light quarks in the factorization of the structure functions, cf. Eqs. (2.97)–(2.100). The LO contribution is then given by the flavor excitation process shown in Figure 5, γ∗ +Q(Q)→ Q(Q) . (3.1) P } PF γ∗ Q(Q) l l′ Figure 5: LO intrinsic heavy quark production. Several experimental and theoretical studies suggest that the intrinsic contribution to the heavy flavor cross section is of the order of 1% or smaller, [90, 91], and we will not consider it any further. 12One may however, also consider photoproduction of heavy quarks in ep collisions where Q2 ≈ 0, which is a widely hadronic process, cf. [256, 257], and especially important for the production of heavy quark resonances, as e.g. the J/Ψ. 34 In extrinsic heavy flavor production, the heavy quarks are produced as final states in virtual gauge boson scattering off massless partons. This description is also referred to as the fixed flavor number scheme. At higher orders, one has to make the distinction between whether one considers the complete inclusive structure functions or only those heavy quark contributions, which can be determined in experiments by tagging the final state heavy quarks. In the former case, virtual corrections containing heavy quark loops have to be included into the theoretical calculation as well, cf. also Section 5.1. We consider only twist-2 parton densities in the Bjorken limit. Therefore no transverse momentum effects in the initial parton distributions will be allowed, since these contribu- tions are related, in the kinematic sense, to higher twist operators. From the conditions for the validity of the parton model, Eqs. (2.51, 2.56), it follows that in the region of not too small nor too large values of the Bjorken variable x, the partonic description holds for massless partons. Evidently, iff Q2(1−x)2/m2 ≫/ 1 no partonic description for a potential heavy quark distribution can be obtained. The question under which circumstances one may introduce a heavy flavor parton density will be further discussed in Section 3.3. In a general kinematic region the parton densities in Eq. (2.97) are enforced to be massless and the heavy quark mass effects are contained in the inclusive Wilson coefficients. These are calculable perturbatively and denoted by CS,PS,NSi,(2,L) ( τ, nf + 1, Q2 µ2 , m2 µ2 ) . (3.2) The argument nf + 1 denotes the presence of nf light and one heavy flavor. τ is the partonic scaling variable defined in Eq. (2.38) and we will present some of the following equations in x–space rather than in Mellin space. One may identify the massless flavor contributions in Eq. (3.2) and separate the Wilson coefficients into a purely light part Ci,(2,L), cf. Eq. (2.97), and a heavy part CS,PS,NSi,(2,L) ( τ, nf + 1, Q2 µ2 , m2 µ2 ) = CS,PS,NSi,(2,L) ( τ, nf , Q2 µ2 ) +HS,PSi,(2,L) ( τ, nf + 1, Q2 µ2 , m2 µ2 ) + LS,PS,NSi,(2,L) ( τ, nf + 1, Q2 µ2 , m2 µ2 ) . (3.3) Here, we denote the heavy flavor Wilson coefficients by Li,j and Hi,j, respectively, de- pending on whether the photon couples to a light (L) or heavy (H) quark line. From this it follows that the light flavor Wilson coefficients Ci,j depend on nf light flavors only, whereas Hi,j and Li,j may contain light flavors in addition to the heavy quark, indicated by the argument nf + 1. The perturbative series of the heavy flavor Wilson coefficients read HSg,(2,L) ( τ, nf + 1, Q2 µ2 , m2 µ2 ) = ∞∑ i=1 aisH (i),S g,(2,L) ( τ, nf + 1, Q2 µ2 , m2 µ2 ) , (3.4) HPSq,(2,L) ( τ, nf + 1, Q2 µ2 , m2 µ2 ) = ∞∑ i=2 aisH (i),PS q,(2,L) ( τ, nf + 1, Q2 µ2 , m2 µ2 ) , (3.5) LSg,(2,L) ( τ, nf + 1, Q2 µ2 , m2 µ2 ) = ∞∑ i=2 aisL (i),S g,(2,L) ( τ, nf + 1, Q2 µ2 , m2 µ2 ) , (3.6) 35 LSq,(2,L) ( τ, nf + 1, Q2 µ2 , m2 µ2 ) = ∞∑ i=2 aisL (i),S q,(2,L) ( τ, nf + 1, Q2 µ2 , m2 µ2 ) . (3.7) Note that we have not yet specified a scheme for treating as, but one has to use the same scheme when combining the above terms with the light flavor Wilson coefficients. At LO, only the term Hg,(2,L) contributes via the photon–gluon fusion process shown in Figure 6, γ∗ + g → Q+Q . (3.8) The LO Wilson coefficients corresponding to this process are given by, [101,102,255] 13, P } PF γ∗ g Q Q l l′ Figure 6: LO extrinsic heavy quark production. H(1)g,2 ( τ, m 2 Q2 ) = 8TF { v [ −1 2 + 4τ(1− τ) + 2m 2 Q2 τ(τ − 1) ] + [ −1 2 + τ − τ 2 + 2m 2 Q2 τ(3τ − 1) + 4 m4 Q4 τ 2 ] ln ( 1− v 1 + v )} , (3.9) H(1)g,L ( τ, m 2 Q2 ) = 16TF [ τ(1− τ)v + 2m 2 Q2 τ 2 ln ( 1− v 1 + v )] . (3.10) The cms velocity v of the produced heavy quark pair is given by v = √ 1− 4m 2τ Q2(1− τ) . (3.11) The LO heavy flavor contributions to the structure functions are then FQQ(2,L)(x,Q2,m2) = e2Qas ∫ 1 ax dz z H (1) g,(2,L) (x z , m2 Q2 ) G(nf , z, Q2) , a = 1 + 4m2/Q2 , (3.12) where the integration boundaries follow from the kinematics of the process. Here eQ denotes the electric charge of the heavy quark. 13Eqs. (16), (17) in Ref. [130] contain misprints 36 At O(a2s), the terms HPSq,(2,L) and LSq,(2,L) contribute as well. They result from the process γ∗ + q(q)→ q(q) +X , (3.13) where X = Q+Q in case of extrinsic heavy flavor production. The latter is of phenomeno- logical relevance if the heavy quarks are detected in the final states, e.g. via the produced Dc–mesons in case Q = c. For a complete inclusive analysis summing over all final states, both light and heavy, one has to include radiative corrections containing virtual heavy quark contributions as well. The term LSq,(2,L) can be split into a NS and a PS piece via LSq,(2,L) = LNSq,(2,L) + LPSq,(2,L), (3.14) where the PS–term emerges for the first time at O(a3s) and the NS–term at O(a2s), re- spectively. Finally, LSg,(2,L) contributes for the first time at O(a3s) in case of heavy quarks in the final state but there is a O(a2s) term involving radiative corrections, which will be commented on in Section 5.1. The terms H(2)g,(2,L), H (2),PS q,(2,L) and L (2),NS q,(2,L) have been calcu- lated in x–space in the complete kinematic range in semi-analytic form in Refs. [103] 14, considering heavy quarks in the final states only. The heavy quark contribution to the structure functions F(2,L)(x,Q2) for one heavy quark of mass m and nf light flavors is then given by, cf. [129] and Eq. (2.97), FQQ(2,L)(x, nf + 1, Q2,m2) = nf∑ k=1 e2k { LNSq,(2,L) ( x, nf + 1, Q2 m2 , m2 µ2 ) ⊗ [ fk(x, µ2, nf ) + fk(x, µ2, nf ) ] + 1 nf LPSq,(2,L) ( x, nf + 1, Q2 m2 , m2 µ2 ) ⊗ Σ(x, µ2, nf ) + 1 nf LSg,(2,L) ( x, nf + 1, Q2 m2 , m2 µ2 ) ⊗G(x, µ2, nf ) } + e2Q [ HPSq,(2,L) ( x, nf + 1, Q2 m2 , m2 µ2 ) ⊗ Σ(x, µ2, nf ) +HSg,(2,L) ( x, nf + 1, Q2 m2 , m2 µ2 ) ⊗G(x, µ2, nf ) ] , (3.15) where the integration boundaries of the Mellin–convolutions follow from phase space kine- matics, cf. Eq. (3.12). 3.2 Asymptotic Heavy Quark Coefficient Functions An important part of the kinematic region in case of heavy flavor production in DIS is located at larger values of Q2, cf. e.g. [247, 258]. As has been shown in Ref. [126], cf. also [129, 259], the heavy flavor Wilson coefficients Hi,j, Li,j factorize in the limit Q2 ≫ m2 into massive operator matrix elements Aki and the massless Wilson coefficients 14A precise representation in Mellin space was given in [116]. 37 Ci,j, if one heavy quark flavor and nf light flavors are considered. The massive OMEs are process independent quantities and contain all the mass dependence except for the power corrections ∝ (m2/Q2)k, k ≥ 1. The process dependence is given by the light flavor Wilson coefficients only. This allows the analytic calculation of the NLO heavy flavor Wilson coefficients, [126, 128]. Comparing these asymptotic expressions with the exact LO and NLO results obtained in Refs. [101, 102] and [103], respectively, one finds that this approximation becomes valid in case of FQQ2 for Q2/m2 >∼ 10. These scales are sufficiently low and match with the region analyzed in deeply inelastic scattering for precision measurements. In case of FQQL , this approximation is only valid for Q2/m2 >∼ 800, [126]. For the latter case, the 3–loop corrections were calculated in Ref. [127]. This difference is due to the emergence of terms ∝ (m2/Q2) ln(m2/Q2), which vanish only slowly in the limit Q2/m2 →∞. In order to derive the factorization formula, one considers the inclusive Wilson coef- ficients CS,PS,NSi,j , which have been defined in Eq. (3.2). After applying the LCE to the partonic tensor, or the forward Compton amplitude, corresponding to the respective Wil- son coefficients, one arrives at the factorization relation, cf. Eq. (2.93), CS,PS,NS,asympj,(2,L) ( N,nf + 1, Q2 µ2 , m2 µ2 ) = ∑ i AS,PS,NSij ( N,nf + 1, m2 µ2 ) CS,PS,NSi,(2,L) ( N,nf + 1, Q2 µ2 ) +O (m2 Q2 ) . (3.16) Here µ refers to the factorization scale between the heavy and light contributions in Cj,i and ’asymp’ denotes the limit Q2 ≫ m2. The Ci,j are precisely the light Wilson coefficients, cf. Eqs. (2.97)–(2.99), taken at nf + 1 flavors. This can be inferred from the fact that in the LCE, Eq. (2.74), the Wilson coefficients describe the singularities for very large values of Q2, which can not depend on the presence of a quark mass. The mass dependence is given by the OMEs Aij, cf. Eqs. (2.80,2.89), between partonic states. Eq. (3.16) accounts for all mass effects but corrections which are power suppressed, (m2/Q2)k, k ≥ 1. This factorization is only valid if the heavy quark coefficient functions are defined in such a way that all radiative corrections containing heavy quark loops are included. Otherwise, (3.16), would not show the correct asymptotic Q2–behavior, [129]. An equivalent way of describing Eq. (3.16) is obtained by considering the calcula- tion of the massless Wilson coefficients. Here, the initial state collinear singularities are given by evaluating the massless OMEs between off–shell partons, leading to transition functions Γij. The Γij are given in terms of the anomalous dimensions of the twist–2 operators and transfer the initial state singularities to the bare parton–densities due to mass factorization, cf. e.g. [126, 129]. In the case at hand, something similar happens: The initial state collinear singularities are transferred to the parton densities except for those which are regulated by the quark mass and described by the OMEs. Instead of absorbing these terms into the parton densities as well, they are used to reconstruct the asymptotic behavior of the heavy flavor Wilson coefficients. Here, AS,NSij ( N,nf + 1, m2 µ2 ) = 〈j|OS,NSi |j〉 = δij + ∞∑ i=1 aisA (i),S,NS ij (3.17) are the operator matrix elements of the local twist–2 operators being defined in Eqs. (2.86)–(2.88) between on–shell partonic states |j〉, j = q, g. As usual, the S contribution 38 can be split into a NS and PS part via ASqq = ANSqq + APSqq . (3.18) Due to the on–shell condition, all contributions but the O(a0s) terms vanish 15 if no heavy quark is present in the virtual loops. This is due to the fact that integrals without scale vanish in dimensional regularization, cf. Section 4.1. Hence only those terms with a mass remain and these are referred to as massive OMEs. The calculation of these massive OMEs is the main objective of this thesis. In case of the gluon operator, (2.88), the contributing terms are denoted by Agq,Q and Agg,Q, where the perturbative series of the former starts at O(a2s) and the one of the latter at O(a0s) 16. For the quark operator, one distinguishes whether the operator couples to a heavy or light quark. In the NS– case, the operator by definition couples to the light quark. Thus there is only one term, ANSqq,Q, which contributes at O(a0s). In the S and PS–case, two OMEs can be distinguished, {APSqq,Q, ASqg,Q} and {APSQq, ASQg}, where in the former case the operator couples to a light quark and in the latter case to a heavy quark. The terms Aqi,Q emerge for the first time at O(a3s), APSQq at O(a2s) and ASQg at O(as). In this work we refer only to the even moments, cf. Section 2.3. In the non–singlet case we will obtain, however, besides the NS+ contributions for the even moments also the NS− terms, which correspond to the odd moments. Eq. (3.16) can now be split into its parts by considering the different nf–terms. We adopt the following notation for a function f(nf ) f˜(nf ) ≡ f(nf ) nf . (3.19) This is necessary in order to separate the different types of contributions in Eq. (3.15), weighted by the electric charges of the light and heavy flavors, respectively. Since we concentrate on only the heavy flavor part, we define as well for later use fˆ(nf ) ≡ f(nf + 1)− f(nf ) , (3.20) with ˆ˜f(nf ) ≡ ̂[f˜(nf )]. The following Eqs. (3.21)–(3.25) are the same as Eqs. (2.31)–(2.35) in Ref. [129]. We present these terms here again, however, since Ref. [129] contains a few inconsistencies regarding the f˜–description. Contrary to the latter reference, the argument corresponding to the number of flavors stands for all flavors, light or heavy. The separation for the NS–term is given by CNSq,(2,L) ( N,nf , Q2 µ2 ) + LNSq,(2,L) ( N,nf + 1, Q2 µ2 , m2 µ2 ) = ANSqq,Q ( N,nf + 1, m2 µ2 ) CNSq,(2,L) ( N,nf + 1, Q2 µ2 ) . (3.21) Here and in the following, we omit the index ”asymp” to denote the asymptotic heavy flavor Wilson coefficients, since no confusion is to be expected. For the remaining terms, 15In Ref. [111] use was made of this fact to calculate the massless Wilson coefficients without having to calculate the massless OMEs. 16The O(a0s) term of Agg does not contain a heavy quark, but still remains in Eq. (3.16) because no loops have to be calculated. 39 we suppress for brevity the arguments N , Q2/µ2 and m2/µ2, all of which can be inferred from Eqs. (3.3, 3.16). Additionally, we will suppress from now on the index S and label only the NS and PS terms explicitly. The contributions to Li,j read CPSq,(2,L)(nf ) + LPSq,(2,L)(nf + 1) = [ ANSqq,Q(nf + 1) + APSqq,Q(nf + 1) +APSQq(nf + 1) ] ×nf C˜PSq,(2,L)(nf + 1) + APSqq,Q(nf + 1)CNSq,(2,L)(nf + 1) +Agq,Q(nf + 1)nf C˜g,(2,L)(nf + 1) , (3.22) Cg,(2,L)(nf ) + Lg,(2,L)(nf + 1) = Agg,Q(nf + 1)nf C˜g,(2,L)(nf + 1) +Aqg,Q(nf + 1)CNSq,(2,L)(nf + 1) + [ Aqg,Q(nf + 1) + AQg(nf + 1) ] nf C˜PSq,(2,L)(nf + 1) . (3.23) The terms Hi,j are given by HPSq,(2,L)(nf + 1) = APSQq(nf + 1) [ CNSq,(2,L)(nf + 1) + C˜PSq,(2,L)(nf + 1) ] + [ ANSqq,Q(nf + 1) + APSqq,Q(nf + 1) ] C˜PSq,(2,L)(nf + 1) +Agq,Q(nf + 1)C˜g,(2,L)(nf + 1) , (3.24) Hg,(2,L)(nf + 1) = Agg,Q(nf + 1)C˜g,(2,L)(nf + 1) + Aqg,Q(nf + 1)C˜PSq,(2,L)(nf + 1) +AQg(nf + 1) [ CNSq,(2,L)(nf + 1) + C˜PSq,(2,L)(nf + 1) ] . (3.25) Expanding the above equations up to O(a3s), we obtain, using Eqs. (3.19, 3.20), the heavy flavor Wilson coefficients in the asymptotic limit : LNSq,(2,L)(nf + 1) = a2s [ A(2),NSqq,Q (nf + 1) δ2 + Cˆ (2),NS q,(2,L)(nf ) ] + a3s [ A(3),NSqq,Q (nf + 1) δ2 + A (2),NS qq,Q (nf + 1)C (1),NS q,(2,L)(nf + 1) +Cˆ(3),NSq,(2,L)(nf ) ] , (3.26) LPSq,(2,L)(nf + 1) = a3s [ A(3),PSqq,Q (nf + 1) δ2 + A (2) gq,Q(nf ) nf C˜ (1) g,(2,L)(nf + 1) +nf ˆ˜C (3),PS q,(2,L)(nf ) ] , (3.27) LSg,(2,L)(nf + 1) = a2sA (1) gg,Q(nf + 1)nf C˜ (1) g,(2,L)(nf + 1) + a3s [ A(3)qg,Q(nf + 1) δ2 + A (1) gg,Q(nf + 1) nf C˜ (2) g,(2,L)(nf + 1) +A(2)gg,Q(nf + 1) nf C˜ (1) g,(2,L)(nf + 1) + A(1)Qg(nf + 1) nf C˜ (2),PS q,(2,L)(nf + 1) + nf ˆ˜C (3) g,(2,L)(nf ) ] , (3.28) HPSq,(2,L)(nf + 1) = a2s [ A(2),PSQq (nf + 1) δ2 + C˜ (2),PS q,(2,L)(nf + 1) ] + a3s [ A(3),PSQq (nf + 1) δ2 + C˜ (3),PS q,(2,L)(nf + 1) 40 +A(2)gq,Q(nf + 1) C˜ (1) g,(2,L)(nf + 1) + A (2),PS Qq (nf + 1) C (1),NS q,(2,L)(nf + 1) ] , (3.29) HSg,(2,L)(nf + 1) = as [ A(1)Qg(nf + 1) δ2 + C˜ (1) g,(2,L)(nf + 1) ] + a2s [ A(2)Qg(nf + 1) δ2 + A (1) Qg(nf + 1) C (1),NS q,(2,L)(nf + 1) + A(1)gg,Q(nf + 1) C˜ (1) g,(2,L)(nf + 1) + C˜ (2) g,(2,L)(nf + 1) ] + a3s [ A(3)Qg(nf + 1) δ2 + A (2) Qg(nf + 1) C (1),NS q,(2,L)(nf + 1) + A(2)gg,Q(nf + 1) C˜ (1) g,(2,L)(nf + 1) + A(1)Qg(nf + 1) { C(2),NSq,(2,L)(nf + 1) + C˜ (2),PS q,(2,L)(nf + 1) } + A(1)gg,Q(nf + 1) C˜ (2) g,(2,L)(nf + 1) + C˜ (3) g,(2,L)(nf + 1) ] . (3.30) Note that δ2 has been defined in Eq. (2.101). The above equations include radiative corrections due to heavy quark loops to the Wilson coefficients. Therefore, in order to compare e.g. with the calculation in Refs. [103], these terms still have to be subtracted. Since the light flavor Wilson coefficients were calculated in the MS–scheme, the same scheme has to be used for the massive OMEs. It should also be thoroughly used for renormalization to derive consistent results in QCD analyzes of deep-inelastic scattering data and to be able to compare to other analyzes directly. This means that one has to take special attendance of which scheme for the definition of as was used. In Section 4.4 we will describe a scheme for as, to which one is naturally led in the course of renormalization. We refer to this scheme as MOM–scheme and present the transformation formula to the MS as well. How this affects the asymptotic heavy flavor Wilson coefficients is described in Section 5.1, where we compare Eqs. (3.26)–(3.30) to those presented in Ref. [126]. 3.3 Heavy Quark Parton Densities The FFNS forms a general starting point to describe and to calculate the heavy fla- vor contributions to the DIS structure functions. Approaching higher values of Q2, one may think of the heavy quark becoming effectively light and thus acquiring an own par- ton density. Different variable flavor scheme treatments were considered in the past, cf. e.g. [260]. Here we follow [129] to obtain a description in complete accordance with the renormalization group in the MS–scheme. In the kinematic region in which the factor- ization relation (3.16) holds, one may redefine the results obtained in the FFNS, which allows for a partonic description at the level of (nf + 1) flavors. In the strict sense, only massless particles can be interpreted as partons in hard scatter- ing processes since the lifetime of these quantum-fluctuations off the hadronic background τlife ∝ 1/(k2⊥ +m2Q) has to be large against the interaction time τint ∝ 1/Q2 in the infinite momentum frame, [204], cf. also Section 2.2.1. In the massive case, τlife is necessarily finite and there exists a larger scale Q20 below which any partonic description fails. From this it follows, that the heavy quark effects are genuinely described by the process depen- dent Wilson coefficients. Since parton-densities are process independent quantities, only process independent pieces out of the Wilson coefficients can be used to define them for heavy quarks at all. Clearly this is impossible in the region close to threshold but requires Q2/m2Q = r ≫ 1, with r >∼ 10 in case of F2(x,Q2). For FL(x,Q2) the corresponding ratio 41 even turns out to be r >∼ 800, [126, 127, 252]. Heavy flavor parton distributions can thus be constructed only for scales µ2 ≫ m2Q. This is done under the further assumption that for the other heavy flavors the masses mQi form a hierarchy m2Q1 ≪ m2Q2 ≪ etc. Their use in observables is restricted to a region, in which the power corrections can be safely neglected. This range may strongly depend on the observable considered as the examples of F2 and FL show. Also in case of the structure functions associated to transverse virtual gauge boson polarizations, like F2(x,Q2), the factorization (3.16) only occurs far above threshold, Q2thr ∼ 4m2Qx/(1− x), and at even larger scales for FL(x,Q2). In order to maintain the process independence of the parton distributions, we define them for (nf + 1) flavors from the light flavor parton distribution functions for nf flavors together with the massive operator matrix elements. The following set of parton densities is obtained in Mellin–space, [129] : fk(nf + 1, N, µ2,m2) + fk(nf + 1, N, µ2,m2) = ANSqq,Q ( N,nf + 1, µ2 m2 ) · [ fk(nf , N, µ2) + fk(nf , N, µ2) ] + 1 nf APSqq,Q ( N,nf + 1, µ2 m2 ) · Σ(nf , N, µ2) + 1 nf Aqg,Q ( N,nf + 1, µ2 m2 ) ·G(nf , N, µ2), (3.31) fQ(nf + 1, N, µ2,m2) + fQ(nf + 1, N, µ2,m2) = APSQq ( N,nf + 1, µ2 m2 ) · Σ(nf , N, µ2) +AQg ( N,nf + 1, µ2 m2 ) ·G(nf , N, µ2) . (3.32) The flavor singlet, non–singlet and gluon densities for (nf + 1) flavors are given by Σ(nf + 1, N, µ2,m2) = [ ANSqq,Q ( N,nf + 1, µ2 m2 ) + APSqq,Q ( N,nf + 1, µ2 m2 ) +APSQq ( N,nf + 1, µ2 m2 )] · Σ(nf , N, µ2) + [ Aqg,Q ( N,nf + 1, µ2 m2 ) + AQg ( N,nf + 1, µ2 m2 )] ·G(nf , N, µ2) , (3.33) ∆k(nf + 1, N, µ2,m2) = fk(nf + 1, N, µ2,m2) + fk(nf + 1, N, µ2,m2) − 1nf + 1 Σ(nf + 1, N, µ2,m2) , (3.34) G(nf + 1, N, µ2,m2) = Agq,Q ( N,nf + 1, µ2 m2 ) · Σ(nf , N, µ2) +Agg,Q ( N,nf + 1, µ2 m2 ) ·G(nf , N, µ2) . (3.35) Note, that the new parton densities depend on the renormalized heavy quark mass m2 = m2(a2s(µ2)). As will be outlined in Sections 4, 5, the corresponding relations for the 42 operator matrix elements depend on the mass–renormalization scheme. This has to be taken into account in QCD-analyzes, in particular, m2 cannot be chosen constant. The quarkonic and gluonic operators obtained in the light–cone expansion can be normalized arbitrarily. It is, however, convenient to chose the relative factor such, that the non- perturbative nucleon-state expectation values, Σ(nf , N, µ2) and G(nf , N, µ2), obey Σ(nf , N = 2, µ2) +G(nf , N = 2, µ2) = 1 (3.36) due to 4-momentum conservation. As a consequence, the OMEs fulfill the relations, [129], ANSqq,Q(N = 2) +APSqq,Q(N = 2) + APSQq(N = 2) + Agq,Q(N = 2) = 1 , (3.37) Aqg,Q(N = 2) +AQg(N = 2) + Agg,Q(N = 2) = 1 . (3.38) The above scenario can be easily followed up to 2-loop order. Also here diagrams con- tribute which carry two different heavy quark flavors. At this level, the additional heavy degree of freedom may be absorbed into the coupling constant and thus decoupled tem- porarily. Beginning with 3-loop order the situation becomes more involved since there are graphs in which two different heavy quark flavors occur in nested topologies, i.e., the corresponding diagrams depend on the ratio ρ = m2c/m2b yielding power corrections in ρ. There is no strong hierarchy between these two masses. The above picture, leading to heavy flavor parton distributions whenever Q2 ≫ m2 will not hold anymore, since, in case of the two-flavor graphs, one cannot decide immediately whether they belong to the c– or the b–quark distribution. Hence, the partonic description can only be maintained within a certain approximation by assuming ρ≪ 1. Conversely, one may extend the kinematic regime for deep-inelastic scattering to define the distribution functions (3.31)–(3.35) upon knowing the power corrections which occur in the heavy flavor Wilson coefficients Hi,j = Hi,j, Li,j. This is the case for 2-loop order. We separate Hi,j ( x, Q 2 m2 , m2 µ2 ) = Hasympi,j ( x, Q 2 m2 , m2 µ2 ) + Hpoweri,j ( x, Q 2 m2 , m2 µ2 ) , (3.39) where Hasympi,j (x,Q2/m2,m2/µ2) denotes the part of the Wilson coefficient given in Eq. (3.16). If one accounts for Hpoweri,j (x,Q2/m2,m2/µ2) in the fixed flavor number scheme, Eqs. (3.31)–(3.35) are still valid, but they do not necessarily yield the dominant contri- butions in the region closer to threshold. There, the kinematics of heavy quarks is by far not collinear, which is the main reason that a partonic description has to fail. Moreover, relation Eq. (2.51) may be violated. In any case, it is not possible to use the partonic description (3.31)–(3.35) alone for other hard processes in a kinematic domain with sig- nificant power corrections. For processes in the high p⊥ region at the LHC, in which condition (2.51) is fulfilled and the characteristic scale µ2 obeys µ2 ≫ m2, one may use heavy flavor parton distributions by proceeding as follows. In the region Q2 >∼ 10 m2 the heavy flavor contributions to the F2(x,Q2)–world data are very well described by the asymptotic representation in the FFNS. For large scales one can then form a variable flavor representation including one heavy flavor distribution, [129]. This process can be iterated towards the next heavier flavor, provided the universal representation holds and all power corrections can be safely neglected. One has to take special care of the fact, that the matching scale in the coupling constant, at which the transition nf → nf + 1 is to be performed, often differs rather significantly from m, cf. [261]. 43 4 Renormalization of Composite Operator Matrix Elements Before renormalizing the massive OMEs, they have to be calculated applying a suitable regularization scheme, for which we apply dimensional regularization in D = 4 + ε di- mensions, see Section 4.1. The unrenormalized massive OMEs are then denoted by a double–hat and are expanded into a perturbative series in the bare coupling constant aˆs 17 via ˆˆAij (mˆ2 µ2 , ε, N ) = δij + ∞∑ l=1 aˆls ˆˆA (l) ij (mˆ2 µ2 , ε, N ) = δij + ∞∑ l=1 aˆls (mˆ2 µ2 )lε/2 ˆˆA (l) ij ( mˆ2 = µ2, ε, N ) . (4.1) The OMEs in Eq. (4.1) depend on ε, the Mellin–Parameter N , the bare mass mˆ and the renormalization scale µ = µR. Also the factorization scale µF will be identified with µ in the following. Note that in the last line of (4.1), the dependence on the ratio of the mass and the renormalization scale was made explicit for each order in aˆs. The possible values of the indices ij have been described in Section 3.2, below Eq. (3.17). The factorization between the massive OMEs and the massless Wilson coefficients (3.16) requires the external legs of the operator matrix elements to be on–shell, p2 = 0 , (4.2) where p denotes the external momentum. Unlike in the massless case, where the scale of the OMEs is set by an off–shell momentum −p2 < 0, in our framework the internal heavy quark mass yields the scale. In the former case, one observes a mixing of the physical OMEs with non–gauge invariant (NGI) operators, cf. [123,262], and contributions originating in the violation of the equations of motion (EOM). Terms of this kind do not contribute in the present case, as will be discussed in Section 4.2. Renormalizing the OMEs then consists of four steps. First, mass and charge renormal- ization have to performed. The former is done in the on–mass–shell–scheme and described in Section 4.3. For the latter, we present the final result in the MS–scheme, but in an intermediate step, we adopt an on–shell subtraction scheme (MOM–scheme) for the gluon propagator, cf. Section 4.4. This is necessary to maintain condition (4.2), i.e., to keep the external massless partons on–shell. Note, that there are other, differing MOM–schemes used in the literature, cf. e.g. [263]. After mass and coupling constant renormalization, we denote the OMEs with a single hat, Aˆij. The remaining singularities are then connected to the composite operators and the particle kinematics of the corresponding Feynman–diagrams. One can distinguish between ultraviolet (UV) and collinear (C) divergences. In Section 4.5, we describe how the former are renormalized via the operator Z–factors. The UV–finite OMEs are de- noted by a bar, A¯ij. Finally, the C–divergences are removed via mass factorization, cf. Section 4.6. The renormalized OMEs are then denoted by Aij. Section 4.7 contains the general structure of the massive OMEs up to O(a3s) in terms of renormalization constants and lower order contributions. 17We would like to remind the reader of the definition of the hat–symbol for a function f, Eq. (3.20), which is not to be confused with the hat–symbol denoting unrenormalized quantities 44 4.1 Regularization Scheme When evaluating momentum integrals of Feynman diagrams in D = 4 dimensions, one encounters singularities, which have to be regularized. A convenient method is to apply D-dimensional regularization, [264, 265]. The dimensionality of space–time is analyti- cally continued to values D 6= 4, for which the corresponding integrals converge. After performing a Wick rotation, integrals in Euclidean space of the form ∫ dDk (2π)D (k2)r (k2 +R2)m = 1 (4π)D/2 Γ(r +D/2)Γ(m− r −D/2) Γ(D/2)Γ(m) (R 2)r+D/2−m (4.3) are obtained. Note that within dimensional regularization, this integral vanishes if R = 0, i.e. if it does not contain a scale, [226]. The properties of the Γ–function in the complex plane are well known, see Appendix C. Therefore one can analytically continue the right- hand side of Eq. (4.3) from integer values of D to arbitrary complex values. In order to recover the physical space-time dimension, we set D = 4 + ε. The singularities can now be isolated by expanding the Γ–functions into Laurent-series around ε = 0. Note that this method regularizes both UV- and C- singularities and one could in principle distinguish their origins by a label, εUV , εC , but we treat all singularities by a common parameter ε in the following. Additionally, all other quantities have to be considered in D dimensions. This applies for the metric tensor gµν and the Clifford-Algebra of γ–matrices, see Appendix A. Also the bare coupling constant gˆs, which is dimensionless in D = 4, has to be continued to D dimensions. Due to this it acquires the dimension of mass, gˆs,D = µ−ε/2gˆs , (4.4) which is described by a scale µ corresponding to the renormalization scale in Eq. (4.1). From now on, Eq. (4.4) is understood to have been applied and we set gˆ2s (4π)2 = aˆs . (4.5) Dimensional regularization has the advantage, unlike the Pauli–Villars regularization, [266], that it obeys all physical requirements such as Lorentz-invariance, gauge invariance and unitarity, [264,267]. Hence it is suitable to be applied in perturbative calculations in quantum field theory including Yang–Mills fields. Using dimensional regularization, the poles of the unrenormalized results appear as terms 1/εi, where in the calculations in this thesis i can run from 1 to the number of loops. In order to remove these singularities, one has to perform renormalization and mass factorization. To do this, a suitable scheme has to be chosen. The most commonly used schemes in perturbation theory are the MS-scheme, [268], and the MS-scheme, [106], to which we will refer in the following. In the MS-scheme only the pole terms in ε are subtracted. More generally, the MS- scheme makes use of the observation that 1/ε–poles always appear in combination with the spherical factor Sε ≡ exp [ε 2 (γE − ln(4π)) ] , (4.6) which may be bracketed out for each loop order. Here γE denotes the Euler-Mascheroni constant γE ≡ limN→∞ ( N∑ k=1 1 k − ln(N) ) ≈ 0.577215664901 . . . . (4.7) 45 By subtracting the poles in the form Sε/ε in the MS-scheme, no terms containing lnk(4π), γkE will appear in the renormalized result, simplifying the expression. This is due to the fact that for a k–loop calculation, one will always obtain the overall term Γ(1− k ε2) (4π) kε2 = Skε exp ( ∞∑ i=2 ζi i (kε 2 )i) , (4.8) with ζi being Riemann’s ζ–values, cf. Appendix C. In the following, we will always assume that the MS-scheme is applied and set Sε ≡ 1. 4.2 Projectors We consider the expectation values of the local operators (2.86)–(2.88) between partonic states j Gij,Q = 〈j | Oi | j〉Q . (4.9) Here, i, j = q, g and the subscript Q denotes the presence of one heavy quark. In case of massless QCD, one has to take the external parton j of momentum p off–shell, p2 < 0, which implies that the OMEs derived from Eq. (4.9) are not gauge invariant. As has been outlined in Ref. [269], they acquire unphysical parts which are due to the breakdown of the equations of motion (EOM) and the mixing with additional non–gauge–invariant (NGI) operators. The EOM terms may be dealt with by applying a suitable projection operator to eliminate them, [269]. The NGI terms are more difficult to deal with, since they affect the renormalization constants and one has to consider additional ghost– and alien– OMEs, see [123,262,269,270] for details. In the case of massive OMEs, these difficulties do not occur. The external particles are massless and taken to be on–shell. Hence the equations of motion are not violated. Additionally, the OMEs remain gauge invariant quantities, since the external states are physical and therefore no mixing with NGI–operators occurs, [123,226,269,270]. The computation of the Green’s functions will reveal trace terms which do not contribute since the local operators are traceless and symmetric under the Lorentz group. It is convenient to project these terms out from the beginning by contracting with an external source term JN ≡ ∆µ1 ...∆µN . (4.10) Here ∆µ is a light-like vector, ∆2 = 0. In this way, the Feynman–rules for composite operators can be derived, cf. Appendix B. In addition, one has to amputate the external field. Note that we nonetheless choose to renormalize the mass and the coupling multi- plicative and include self–energy insertions containing massive lines on external legs into our calculation. The Green’s functions in momentum space corresponding to the OMEs with external gluons are then given by ǫµ(p)GabQ,µνǫν(p) = ǫµ(p)JN〈Aaµ(p) | OQ;µ1...µN | Abν(p)〉ǫν(p) , (4.11) ǫµ(p)Gabq,Q,µνǫν(p) = ǫµ(p)JN〈Aaµ(p) | Oq;µ1...µN | Abν(p)〉Qǫν(p) , (4.12) ǫµ(p)Gabg,Q,µνǫν(p) = ǫµ(p)JN〈Aaµ(p) | Og;µ1...µN | Abν(p)〉Qǫν(p) . (4.13) In Eqs. (4.11-4.13), Aaµ denote the external gluon fields with color index a, Lorentz index µ and momentum p. The polarization vector of the external gluon is given by ǫµ(p). Note 46 that in Eq. (4.11), the operator couples to the heavy quark. In Eqs. (4.12, 4.13) it couples to a light quark or gluon, respectively, with the heavy quark still being present in virtual loops. In the flavor non–singlet case, there is only one term which reads u(p, s)Gij,NSq,Q λru(p, s) = JN〈Ψi(p) | ONSq,r;µ1...µN | Ψ j(p)〉Q , (4.14) with u(p, s), u(p, s) being the bi–spinors of the external massless quark and anti–quark, respectively. The remaining Green’s functions with an outer quark are given by u(p, s)GijQu(p, s) = JN〈Ψi(p) | OQ,µ1...µN | Ψj(p)〉 , (4.15) u(p, s)Gijq,Qu(p, s) = JN〈Ψi(p) | Oq,µ1...µN | Ψj(p)〉Q , (4.16) u(p, s)Gijg,Qu(p, s) = JN〈Ψi(p) | Og,µ1...µN | Ψj(p)〉Q . (4.17) Note that in the quarkonic case the fields Ψ, Ψ with color indices i, j stand for the external light quarks only. Further, we remind that the S– contributions are split up according to Eq. (3.18), which is of relevance for Eq. (4.16). The above tensors have the general form, cf. [126,269], GˆabQ,µν = ˆˆAQg (mˆ2 µ2 , ε, N ) δab(∆ · p)N [ − gµν + pµ∆ν +∆µpν ∆ · p ] , (4.18) Gˆabl,Q,µν = ˆˆAlg,Q (mˆ2 µ2 , ε, N ) δab(∆ · p)N [ − gµν + pµ∆ν +∆µpν ∆ · p ] , l = g, q , (4.19) GˆijQ = ˆˆA PS Qq (mˆ2 µ2 , ε, N ) δij(∆ · p)N−1/∆ , (4.20) Gˆij,rl,Q = ˆˆA r lq,Q (mˆ2 µ2 , ε, N ) δij(∆ · p)N−1/∆ , l = g, q , r = S, NS, PS . (4.21) Here, we have denoted the Green’s function with a hat to signify that the above equations are written on the unrenormalized level. In order to simplify the evaluation, it is useful to define projection operators which, applied to the Green’s function, yield the corresponding OME. For outer gluons, one defines P (1)g Gˆabl,(Q),µν ≡ − δab N2c − 1 gµν D − 2(∆ · p) −NGˆabl,(Q),µν , (4.22) P (2)g Gˆabl,(Q),µν ≡ δab N2c − 1 1 D − 2(∆ · p) −N ( −gµν + p µ∆ν + pν∆µ ∆ · p ) Gˆabl,(Q),µν . (4.23) The difference between the gluonic projectors, Eq. (4.22) and Eq. (4.23), can be traced back to the fact that in the former case, the summation over indices µ, ν includes un- physical transverse gluon states. These have to be compensated by adding diagrams with external ghost lines, which is not the case when using the physical projector in Eq. (4.23). In the case of external quarks there is only one projector which reads PqGˆijl,(Q) ≡ δij Nc (∆ · p)−N 1 4 Tr[ /p Gˆijl,(Q)] . (4.24) 47 In Eqs. (4.22)–(4.24), Nc denotes the number of colors, cf. Appendix A. The unrenor- malized OMEs are then obtained by ˆˆAlg (mˆ2 µ2 , ε, N ) = P (1,2)g Gˆabl,(Q),µν , (4.25) ˆˆAlq (mˆ2 µ2 , ε, N ) = PqGˆijl,(Q) . (4.26) The advantage of these projection operators is that one does not have to resort to compli- cated tensorial reduction. In perturbation theory, the expressions in Eqs. (4.25, 4.26) can then be evaluated order by order in the coupling constant by applying the Feynman-rules given in Appendix B. 4.3 Renormalization of the Mass In a first step, we perform mass renormalization. There are two traditional schemes for mass renormalization: the on–shell–scheme and the MS–scheme. In the following, we will apply the on–shell–scheme, defining the renormalized mass m as the pole of the quark propagator. The differences to the MS–scheme will be discussed in Section 5. The bare mass in Eq. (4.1) is replaced by the renormalized on–shell mass m via mˆ = Zmm = m [ 1 + aˆs (m2 µ2 )ε/2 δm1 + aˆ2s (m2 µ2 )ε δm2 ] +O(aˆ3s) . (4.27) The constants in the above equation are given by 18 δm1 = CF [6 ε − 4 + ( 4 + 3 4 ζ2 ) ε ] (4.28) ≡ δm (−1) 1 ε + δm (0) 1 + δm (1) 1 ε , (4.29) δm2 = CF { 1 ε2 ( 18CF − 22CA + 8TF (nf +Nh) ) + 1 ε ( −45 2 CF + 91 2 CA −14TF (nf +Nh) ) + CF (199 8 − 51 2 ζ2 + 48 ln(2)ζ2 − 12ζ3 ) +CA ( −605 8 + 5 2 ζ2 − 24 ln(2)ζ2 + 6ζ3 ) +TF [ nf (45 2 + 10ζ2 ) +Nh (69 2 − 14ζ2 )]} (4.30) ≡ δm (−2) 2 ε2 + δm(−1)2 ε + δm (0) 2 . (4.31) Eq. (4.28) is easily obtained. In Eq. (4.30), nf denotes the number of light flavors and Nh the number of heavy flavors, which we will set equal to Nh = 1 from now on. The pole contributions were given in Refs. [271, 272], and the constant term was derived in Refs. [273], cf. also [274]. In Eqs. (4.29, 4.31), we have defined the expansion coefficients 18Note that there is a misprint in the double–pole term of Eq. (28) in Ref. [137]. 48 in ε of the corresponding quantities. After mass renormalization, the OMEs read up to O(aˆ3s) ˆˆAij (m2 µ2 , ε, N ) = δij + aˆs ˆˆA (1) ij (m2 µ2 , ε, N ) +aˆ2s [ ˆˆA (2) ij (m2 µ2 , ε, N ) + δm1 (m2 µ2 )ε/2md dm ˆˆA (1) ij (m2 µ2 , ε, N )] +aˆ3s [ ˆˆA (3) ij (m2 µ2 , ε, N ) + δm1 (m2 µ2 )ε/2md dm ˆˆA (2) ij (m2 µ2 , ε, N ) +δm2 (m2 µ2 )εmd dm ˆˆA (1) ij (m2 µ2 , ε, N ) + δm21 2 (m2 µ2 )εm2d2 dm2 ˆˆA (1) ij (m2 µ2 , ε, N )] . (4.32) 4.4 Renormalization of the Coupling Next, we consider charge renormalization. At this point it becomes important to define in which scheme the strong coupling constant is renormalized, cf. Section 3.2. We briefly summarize the main steps in the massless case for nf flavors in the MS–scheme. The bare coupling constant aˆs is expressed by the renormalized coupling aMSs via aˆs = ZMSg 2 (ε, nf )aMSs (µ2) = aMSs (µ2) [ 1 + δaMSs,1 (nf )aMSs (µ2) + δaMSs,2 (nf )aMSs 2 (µ2) ] +O(aMSs 3 ) . (4.33) The coefficients in Eq. (4.33) are, [39–41,275] and [276], δaMSs,1 (nf ) = 2 εβ0(nf ) , (4.34) δaMSs,2 (nf ) = 4 ε2β 2 0(nf ) + 1 εβ1(nf ) , (4.35) with β0(nf ) = 11 3 CA − 4 3 TFnf , (4.36) β1(nf ) = 34 3 C2A − 4 ( 5 3 CA + CF ) TFnf . (4.37) From the above equations, one can determine the β–function, Eq. (2.103), which describes the running of the strong coupling constant and leads to asymptotic freedom in case of QCD, [39,40]. It can be calculated using the fact that the bare strong coupling constant does not depend on the renormalization scale µ. Using Eq. (4.4), one obtains 0 = daˆs,D d lnµ2 = d d lnµ2 aˆsµ −ε = d d lnµ2as(µ 2)Z2g (ε, nf , µ2)µ−ε , (4.38) =⇒ β = ε 2 as(µ2)− 2as(µ2) d d lnµ2 lnZg(ε, nf , µ 2) . (4.39) 49 Note that in Eq. (4.39) we have not specified a scheme yet and kept a possible µ– dependence for Zg, which is not present in case of the MS–scheme. From (4.39), one can calculate the expansion coefficients of the β–function. Combining it with the re- sult for ZMSg in Eqs. (4.34, 4.35), one obtains in the MS-scheme for nf light flavors, cf. [39–41,275,276], βMS(nf ) = −β0(nf )aMSs 2 − β1(nf )aMSs 3 +O(aMSs 4 ) . (4.40) Additionally, it follows das(µ2) d ln(µ2) = 1 2 εas(µ2)− ∞∑ k=0 βkak+2s (µ2) . (4.41) The factorization relation (3.16) strictly requires that the external massless particles are on–shell. Massive loop corrections to the gluon propagator violate this condition, which has to be enforced subtracting the corresponding corrections. These can be uniquely absorbed into the strong coupling constant applying the background field method, [277], to maintain the Slavnov-Taylor identities of QCD. We thus determine the coupling constant renormalization in the MS-scheme as far as the light flavors and the gluon are concerned. In addition, we make the choice that the heavy quark decouples in the running coupling constant as(µ2) for µ2 < m2 and thus from the renormalized OMEs. This implies the requirement that ΠH(0,m2) = 0, where ΠH(p2,m2) is the contribution to the gluon self- energy due to the heavy quark loops, [126]. Since this condition introduces higher order terms in ε into Zg, we left the MS–scheme. This new scheme is a MOM–scheme. After mass renormalization in the on–shell–scheme via Eq. (4.27), we obtain for the heavy quark contributions to the gluon self–energy in the background field formalism ΠˆµνH,ab,BF(p2,m2, µ2, ε, aˆs) = i(−p2gµν + pµpν)δabΠˆH,BF(p2,m2, µ2, ε, aˆs) , ΠˆH,BF(0,m2, µ2, ε, aˆs) = aˆs 2β0,Q ε (m2 µ2 )ε/2 exp ( ∞∑ i=2 ζi i (ε 2 )i) +aˆ2s (m2 µ2 )ε [ 1 ε ( −20 3 TFCA − 4TFCF ) − 32 9 TFCA + 15TFCF +ε ( −86 27 TFCA − 31 4 TFCF − 5 3 ζ2TFCA − ζ2TFCF )] , (4.42) with β0,Q = βˆ0(nf ) = − 4 3 TF . (4.43) Note that Eq. (4.42) holds only up to order O(ε), although we have partially included higher orders in ε in order to keep the expressions shorter. We have used the Feynman– rules of the background field formalism as given in Ref. [190]. In the following, we define f(ε) ≡ (m2 µ2 )ε/2 exp ( ∞∑ i=2 ζi i (ε 2 )i) . (4.44) 50 The renormalization constant of the background field ZA is related to Zg via ZA = Z−2g . (4.45) The light flavor contributions to ZA, ZA,l, can thus be determined by combining Eqs. (4.34, 4.35, 4.45). The heavy flavor part follows from the condition ΠH,BF(0,m2) + ZA,H ≡ 0 , (4.46) which ensures that the on–shell gluon remains strictly massless. Thus we newly define the renormalization constant of the strong coupling with nf light and one heavy flavor as ZMOMg (ε, nf + 1, µ2,m2) ≡ 1 (ZA,l + ZA,H)1/2 (4.47) and obtain ZMOMg 2(ε, nf + 1, µ2,m2) = 1 + aMOMs (µ2) [2 ε (β0(nf ) + β0,Qf(ε)) ] +aMOMs 2(µ2) [β1(nf ) ε + 4 ε2 (β0(nf ) + β0,Qf(ε)) 2 + 1 ε (m2 µ2 )ε( β1,Q + εβ(1)1,Q + ε2β (2) 1,Q )] +O(aMOMs 3) , (4.48) with β1,Q = βˆ1(nf ) = −4 ( 5 3 CA + CF ) TF , (4.49) β(1)1,Q = − 32 9 TFCA + 15TFCF , (4.50) β(2)1,Q = − 86 27 TFCA − 31 4 TFCF − ζ2 ( 5 3 TFCA + TFCF ) . (4.51) The coefficients corresponding to Eq. (4.33) then read in the MOM–scheme δaMOMs,1 = [2β0(nf ) ε + 2β0,Q ε f(ε) ] , (4.52) δaMOMs,2 = [β1(nf ) ε + (2β0(nf ) ε + 2β0,Q ε f(ε) )2 + 1 ε (m2 µ2 )ε( β1,Q + εβ(1)1,Q + ε2β (2) 1,Q )] +O(ε2) . (4.53) Since the MS–scheme is commonly used, we transform our results back from the MOM– description into the MS–scheme, in order to be able to compare to other analyzes. This is achieved by observing that the bare coupling does not change under this transformation and one obtains the condition ZMSg 2 (ε, nf + 1)aMSs (µ2) = ZMOMg 2(ε, nf + 1, µ2,m2)aMOMs (µ2) . (4.54) The following relations hold : aMOMs = aMSs − β0,Q ln (m2 µ2 ) aMSs 2 + [ β20,Q ln2 (m2 µ2 ) − β1,Q ln (m2 µ2 ) − β(1)1,Q ] aMSs 3 +O(aMSs 4 ) , (4.55) 51 or, aMSs = aMOMs + aMOMs 2 ( δaMOMs,1 − δaMSs,1 (nf + 1) ) + aMOMs 3 ( δaMOMs,2 − δaMSs,2 (nf + 1) −2δaMSs,1 (nf + 1) [ δaMOMs,1 − δaMSs,1 (nf + 1) ]) +O(aMOMs 4) , (4.56) vice versa. Eq. (4.56) is valid to all orders in ε. Here, aMSs = aMSs (nf + 1). Applying the on–shell–scheme for mass renormalization and the described MOM–scheme for the renormalization of the coupling, one obtains as general formula for mass and coupling constant renormalization up to O(aMOMs 3) Aˆij = δij + aMOMs ˆˆA (1) ij + aMOMs 2 [ ˆˆA (2) ij + δm1 (m2 µ2 )ε/2 m ddm ˆˆA (1) ij + δaMOMs,1 ˆˆA (1) ij ] +aMOMs 3 [ ˆˆA (3) ij + δaMOMs,2 ˆˆA (1) ij + 2δaMOMs,1 ( ˆˆA (2) ij + δm1 (m2 µ2 )ε/2 m ddm ˆˆA (1) ij ) +δm1 (m2 µ2 )ε/2 m ddm ˆˆA (2) ij + δm2 (m2 µ2 )ε m ddm ˆˆA (1) ij + δm21 2 (m2 µ2 )ε m2 d 2 dm2 ˆˆA (1) ij ] , (4.57) where we have suppressed the dependence on m, ε and N in the arguments 19. 4.5 Operator Renormalization The renormalization of the UV singularities of the composite operators is being performed introducing the corresponding Zij-factors, which have been defined in Eqs. (2.105, 2.106). We consider first only nf massless flavors, cf. [269], and do then include subsequently one heavy quark. In the former case, renormalization proceeds in the MS–scheme via ANSqq (−p2 µ2 , a MS s , nf , N ) = Z−1,NSqq (aMSs , nf , ε, N)AˆNSqq (−p2 µ2 , a MS s , nf , ε, N ) , (4.58) Aij (−p2 µ2 , a MS s , nf , N ) = Z−1il (aMSs , nf , ε, N)Aˆlj (−p2 µ2 , a MS s , nf , ε, N ) , i, j = q, g, (4.59) with p a space–like momentum. As is well known, operator mixing occurs in the singlet case, Eq. (4.59). As mentioned before, we neglected all terms being associated to EOM and NGI parts, since they do not contribute in the renormalization of the massive on–shell operator matrix elements. The NS and PS contributions are separated via Z−1qq = Z−1,PSqq + Z−1,NSqq , (4.60) Aqq = APSqq + ANSqq . (4.61) 19Here we corrected a typographical error in [137], Eq. (48). 52 The anomalous dimensions γij of the operators are defined in Eqs. (2.107, 2.108) and can be expanded in a perturbative series as follows γS,PS,NSij (aMSs , nf , N) = ∞∑ l=1 aMSs l γ(l),S,PS,NSij (nf , N) . (4.62) Here, the PS contribution starts at O(a2s). In the following, we do not write the depen- dence on the Mellin–variable N for the OMEs, the operator Z–factors and the anomalous dimensions explicitly. Further, we will suppress the dependence on ε for unrenormalized quantities and Z–factors. From Eqs. (2.107, 2.108), one can determine the relation be- tween the anomalous dimensions and the Z–factors order by order in perturbation theory. In the general case, one finds up to O(aMSs 3 ) Zij(aMSs , nf ) = δij + aMSs γ(0)ij ε + a MS s 2 { 1 ε2 (1 2 γ(0)il γ (0) lj + β0γ (0) ij ) + 1 2εγ (1) ij } +aMSs 3 { 1 ε3 (1 6 γ(0)il γ (0) lk γ (0) kj + β0γ (0) il γ (0) lj + 4 3 β20γ (0) ij ) + 1 ε2 (1 6 γ(1)il γ (0) lj + 1 3 γ(0)il γ (1) lj + 2 3 β0γ(1)ij + 2 3 β1γ(0)ij ) + γ(2)ij 3ε } . (4.63) The NS and PS Z–factors are given by 20 ZNSqq (aMSs , nf ) = 1 + aMSs γ(0),NSqq ε + a MS s 2 { 1 ε2 (1 2 γ(0),NSqq 2 + β0γ(0),NSqq ) + 1 2εγ (1),NS qq } +aMSs 3 { 1 ε3 (1 6 γ(0),NSqq 3 + β0γ(0),NSqq 2 + 4 3 β20γ(0),NSqq ) + 1 ε2 (1 2 γ(0),NSqq γ(1),NSqq + 2 3 β0γ(1),NSqq + 2 3 β1γ(0),NSqq ) + 1 3εγ (2),NS qq } , (4.64) ZPSqq (aMSs , nf ) = aMSs 2 { 1 2ε2γ (0) qg γ(0)gq + 1 2εγ (1),PS qq } + aMSs 3 { 1 ε3 (1 3 γ(0)qq γ(0)qg γ(0)gq + 1 6 γ(0)qg γ(0)gg γ(0)gq + β0γ(0)qg γ(0)gq ) + 1 ε2 (1 3 γ(0)qg γ(1)gq + 1 6 γ(1)qg γ(0)gq + 1 2 γ(0)qq γ(1),PSqq + 2 3 β0γ(1),PSqq ) + γ(2),PSqq 3ε } . (4.65) All quantities in Eqs. (4.63)–(4.65) refer to nf light flavors and renormalize the massless off–shell OMEs given in Eqs. (4.58, 4.59). In the next step, we consider an additional heavy quark with mass m. We keep the external momentum artificially off–shell for the moment, in order to deal with the UV–singularities only. For the additional massive quark, one has to account for the 20In Eq. (4.65) we corrected typographical errors contained in Eq. (34), [137]. 53 renormalization of the coupling constant we defined in Eqs. (4.52, 4.53). The Z–factors including one massive quark are then obtained by taking Eqs. (4.63)–(4.65) at (nf + 1) flavors and performing the scheme transformation given in (4.56). The emergence of δaMOMs,k in Zij is due to the finite mass effects and cancels singularities which emerge for real radiation and virtual processes at p2 → 0. Thus one obtains up to O(aMOMs 3) Z−1ij (aMOMs , nf + 1, µ2) = δij − aMOMs γ(0)ij ε + a MOM s 2 [ 1 ε ( −1 2 γ(1)ij − δaMOMs,1 γ (0) ij ) + 1 ε2 (1 2 γ(0)il γ (0) lj + β0γ (0) ij )] + aMOMs 3 [ 1 ε ( −1 3 γ(2)ij − δaMOMs,1 γ (1) ij −δaMOMs,2 γ (0) ij ) + 1 ε2 (4 3 β0γ(1)ij + 2δaMOMs,1 β0γ (0) ij + 1 3 β1γ(0)ij +δaMOMs,1 γ (0) il γ (0) lj + 1 3 γ(1)il γ (0) lj + 1 6 γ(0)il γ (1) lj ) + 1 ε3 ( −4 3 β20γ (0) ij −β0γ(0)il γ (0) lj − 1 6 γ(0)il γ (0) lk γ (0) kj )] , (4.66) and Z−1,NSqq (aMOMs , nf + 1, µ2) = 1− aMOMs γ(0),NSqq ε + a MOM s 2 [ 1 ε ( −1 2 γ(1),NSqq − δaMOMs,1 γ(0),NSqq ) + 1 ε2 ( β0γ(0),NSqq + 1 2 γ(0),NSqq 2 )] + aMOMs 3 [ 1 ε ( −1 3 γ(2),NSqq −δaMOMs,1 γ(1),NSqq − δaMOMs,2 γ(0),NSqq ) + 1 ε2 (4 3 β0γ(1),NSqq +2δaMOMs,1 β0γ(0),NSqq + 1 3 β1γ(0),NSqq + 1 2 γ(0),NSqq γ(1),NSqq +δaMOMs,1 γ(0),NSqq 2 ) + 1 ε3 ( −4 3 β20γ(0),NSqq −β0γ(0),NSqq 2 − 1 6 γ(0),NSqq 3 )] , (4.67) Z−1,PSqq (aMOMs , nf + 1, µ2) = aMOMs 2 [ 1 ε ( −1 2 γ(1),PSqq ) + 1 ε2 (1 2 γ(0)qg γ(0)gq )] +aMOMs 3 [ 1 ε ( −1 3 γ(2),PSqq − δaMOMs,1 γ(1),PSqq ) + 1 ε2 (1 6 γ(0)qg γ(1)gq + 1 3 γ(0)gq γ(1)qg + 1 2 γ(0)qq γ(1),PSqq + 4 3 β0γ(1),PSqq + δaMOMs,1 γ(0)qg γ(0)gq ) + 1 ε3 ( −1 3 γ(0)qg γ(0)gq γ(0)qq − 1 6 γ(0)gq γ(0)qg γ(0)gg − β0γ(0)qg γ(0)gq )] . (4.68) The above equations are given for nf + 1 flavors. One re-derives the expressions for nf light flavors by setting (nf + 1) =: nf and δaMOMs = δaMSs . As a next step, we split the 54 OMEs into a part involving only light flavors and the heavy flavor part Aˆij(p2,m2, µ2, aMOMs , nf + 1) = Aˆij (−p2 µ2 , a MS s , nf ) +AˆQij(p2,m2, µ2, aMOMs , nf + 1) . (4.69) In (4.69, 4.70), the light flavor part depends on aMSs , since the prescription adopted for coupling constant renormalization only applies to the massive part. AˆQij denotes any massive OME we consider. The correct UV–renormalization prescription for the massive contribution is obtained by subtracting from Eq. (4.69) the terms applying to the light part only : A¯Qij(p2,m2, µ2, aMOMs , nf + 1) = Z−1il (aMOMs , nf + 1, µ2)Aˆ Q ij(p2,m2, µ2, aMOMs , nf + 1) +Z−1il (aMOMs , nf + 1, µ2)Aˆij (−p2 µ2 , a MS s , nf ) −Z−1il (aMSs , nf , µ2)Aˆij (−p2 µ2 , a MS s , nf ) , (4.70) where Z−1ij = δij + ∞∑ k=1 aksZ −1,(k) ij . (4.71) In the limit p2 = 0, integrals without a scale vanish within dimensional regularization. Hence for the light flavor OMEs only the term δij remains and one obtains the UV–finite massive OMEs after expanding in as A¯Qij (m2 µ2 , a MOM s , nf + 1 ) = aMOMs ( Aˆ(1),Qij (m2 µ2 ) + Z−1,(1)ij (nf + 1, µ2)− Z −1,(1) ij (nf ) ) +aMOMs 2 ( Aˆ(2),Qij (m2 µ2 ) + Z−1,(2)ij (nf + 1, µ2)− Z −1,(2) ij (nf ) + Z−1,(1)ik (nf + 1, µ2)Aˆ (1),Q kj (m2 µ2 )) +aMOMs 3 ( Aˆ(3),Qij (m2 µ2 ) + Z−1,(3)ij (nf + 1, µ2)− Z −1,(3) ij (nf ) + Z−1,(1)ik (nf + 1, µ2)Aˆ (2),Q kj (m2 µ2 ) + Z−1,(2)ik (nf + 1, µ2)Aˆ (1),Q kj (m2 µ2 )) . (4.72) The Z–factors at nf + 1 flavors refer to Eqs. (4.66)–(4.68), whereas those at nf flavors correspond to the massless case. 4.6 Mass Factorization Finally, we have to remove the collinear singularities contained in A¯ij, which emerge in the limit p2 = 0. They are absorbed into the parton distribution functions and are not 55 present in case of the off–shell massless OMEs. As a generic renormalization formula, generalizing Eqs. (4.58, 4.59), one finds Aij = Z−1il AˆlkΓ−1kj . (4.73) The renormalized operator matrix elements are obtained by AQij (m2 µ2 , a MOM s , nf + 1 ) = A¯Qil (m2 µ2 , a MOM s , nf + 1 ) Γ−1lj . (4.74) If all quarks were massless, the identity, [126], Γij = Z−1ij . (4.75) would hold. However, due to the presence of a heavy quark Q, the transition functions Γ(nf ) refer only to massless sub-graphs. Hence the Γ–factors contribute up to O(a2s) only and do not involve the special scheme adopted for the renormalization of the coupling. Due to Eq. (4.75), they can be read off from Eqs. (4.63)–(4.65). The renormalized operator matrix elements are then given by: AQij (m2 µ2 , a MOM s , nf + 1 ) = aMOMs ( Aˆ(1),Qij (m2 µ2 ) + Z−1,(1)ij (nf + 1)− Z −1,(1) ij (nf ) ) +aMOMs 2 ( Aˆ(2),Qij (m2 µ2 ) + Z−1,(2)ij (nf + 1)− Z −1,(2) ij (nf ) + Z −1,(1) ik (nf + 1)Aˆ (1),Q kj (m2 µ2 ) + [ Aˆ(1),Qil (m2 µ2 ) + Z−1,(1)il (nf + 1)− Z −1,(1) il (nf ) ] Γ−1,(1)lj (nf ) ) +aMOMs 3 ( Aˆ(3),Qij (m2 µ2 ) + Z−1,(3)ij (nf + 1)− Z −1,(3) ij (nf ) + Z −1,(1) ik (nf + 1)Aˆ (2),Q kj (m2 µ2 ) + Z−1,(2)ik (nf + 1)Aˆ (1),Q kj (m2 µ2 ) + [ Aˆ(1),Qil (m2 µ2 ) + Z−1,(1)il (nf + 1) − Z−1,(1)il (nf ) ] Γ−1,(2)lj (nf ) + [ Aˆ(2),Qil (m2 µ2 ) + Z−1,(2)il (nf + 1)− Z −1,(2) il (nf ) + Z−1,(1)ik (nf + 1)Aˆ (1),Q kl (m2 µ2 )] Γ−1,(1)lj (nf ) ) +O(aMOMs 4) . (4.76) From (4.76) it is obvious that the renormalization of AQij to O(a3s) requires the 1–loop terms up to O(ε2) and the 2–loop terms up to O(ε), cf. [126, 128–130, 137]. These terms are calculated in Section 6. Finally, we transform the coupling constant back into the MS–scheme by using Eq. (4.55). We do not give the explicit formula here, but present the individual renormalized OMEs after this transformation in the next Section as per- turbative series in aMSs , AQij (m2 µ2 , a MS s , nf + 1 ) = δij + aMSs A Q,(1) ij (m2 µ2 , nf + 1 ) + aMSs 2 AQ,(2)ij (m2 µ2 , nf + 1 ) +aMSs 3 AQ,(3)ij (m2 µ2 , nf + 1 ) +O(aMSs 4 ) . (4.77) 56 As stated in Section 3, one has to use the same scheme when combining the massive OMEs with the massless Wilson coefficients in the factorization formula (3.16). The effects of the transformation between the MOM– and MS–scheme are discussed in Section 5. The subscript Q was introduced in this Section to make the distinction between the massless and massive OMEs explicit and will be dropped from now on, since no confusion is expected. Comparing Eqs. (4.76) and (4.77), one notices that the term δij is not present in the former because it was subtracted together with the light flavor contributions. However, as one infers from Eq. (3.16) and the discussion below, this term is necessary when calculating the massive Wilson coefficients in the asymptotic limit and we therefore have re–introduced it into Eq. (4.77). 4.7 General Structure of the Massive Operator Matrix Ele- ments In the following, we present the general structure of the unrenormalized and renormalized massive operator matrix elements for the specific partonic channels. The former are expressed as a Laurent–series in ε via ˆˆA (l) ij (mˆ2 µ2 , ε, N ) = (mˆ2 µ2 )lε/2 ∞∑ k=0 a(l,k)ij εl−k . (4.78) Additionally, we set a(l,l)ij ≡ a (l) ij , a (l,l+1) ij ≡ a (l) ij , etc. . (4.79) The pole terms can all be expressed by known renormalization constants and lower order contributions to the massive OMEs, which provides us with a strong check on our calcu- lation. In particular, the complete NLO anomalous dimensions, as well as their TF–terms at NNLO, contribute at O(a3s). The moments of the O(ε0)–terms of the unrenormalized OMEs at the 3–loop level, a(3)ij , are a new result of this thesis and will be calculated in Section 7, cf. [134]. The O(ε) terms at the 2–loop level, a(2)ij , contribute to the non– logarithmic part of the renormalized 3–loop OMEs and are calculated for general values of N in Section 6, cf. [130, 137]. The pole terms and the O(ε0) terms, a(2)ij , at 2–loop have been calculated for the first time in Refs. [126, 129]. The terms involving the quark operator, (2.86, 2.87), were confirmed in [128] and the terms involving the gluon oper- ator (2.88) by the present work, cf. [130]. In order to keep up with the notation used in [126, 129], we define the 2–loop terms a(2)ij , a (2) ij after performing mass renormalization in the on–shell–scheme. This we do not apply for the 3–loop terms. We choose to calcu- late one–particle reducible diagrams and therefore have to include external self–energies containing massive quarks into our calculation. Before presenting the operator matrix elements up to three loops, we first summarize the necessary self–energy contributions in the next Section. The remaining Sections, (4.7.2)–(4.7.6), contain the general structure of the unrenormalized and renormalized massive OMEs up to 3–loops. In these Sections, we always proceed as follows: From Eqs. (4.57, 4.76), one predicts the pole terms of the respective unrenormalized OMEs by demanding that these terms have to cancel through renormalization. The unrenormalized expressions are then renormalized in the MOM– scheme. Finally, Eq. (4.55) is applied and the renormalized massive OMEs are presented in the MS–scheme. 57 4.7.1 Self–energy contributions The gluon and quark self-energy contributions due to heavy quark lines are given by Πˆabµν(p2, mˆ2, µ2, aˆs) = iδab [ −gµνp2 + pµpν ] Πˆ(p2, mˆ2, µ2, aˆs) , (4.80) Πˆ(p2, mˆ2, µ2, aˆs) = ∞∑ k=1 aˆksΠˆ(k)(p2, mˆ2, µ2). (4.81) Σˆij(p2, mˆ2, µ2, aˆs) = i δij /p Σˆ(p2, mˆ2, µ2, aˆs) , (4.82) Σˆ(p2, mˆ2, µ2, aˆs) = ∞∑ k=2 aˆksΣˆ(k)(p2, mˆ2, µ2) . (4.83) Note, that the quark self–energy contributions start at 2–loop order. These self–energies are easily calculated using MATAD, [164], cf. Section 7. The expansion coefficients for p2 = 0 of Eqs. (4.82, 4.83) are needed for the calculation of the gluonic and quarkonic OMEs, respectively. The contributions to the gluon vacuum polarization for general gauge parameter ξ are Πˆ(1) ( 0, mˆ 2 µ2 ) = TF (mˆ2 µ2 )ε/2 ( − 8 3ε exp ( ∞∑ i=2 ζi i (ε 2 )i) ) , (4.84) Πˆ(2) ( 0, mˆ 2 µ2 ) = TF (mˆ2 µ2 )ε ( − 4ε2CA + 1 ε { −12CF + 5CA } + CA (13 12 − ζ2 ) − 13 3 CF +ε { CA (169 144 + 5 4 ζ2 − ζ3 3 ) + CF ( −35 12 − 3ζ2 )}) +O(ε2) , (4.85) Πˆ(3) ( 0, mˆ 2 µ2 ) = TF (mˆ2 µ2 )3ε/2 ( 1 ε3 { −32 9 TFCA ( 2nf + 1 ) + C2A (164 9 + 4 3 ξ )} + 1 ε2 { 80 27 ( CA − 6CF ) nfTF + 8 27 ( 35CA − 48CF ) TF + C2A 27 ( −781 +63ξ ) + 712 9 CACF } + 1 ε { 4 27 ( CA(−101− 18ζ2)− 62CF ) nfTF + 2 27 ( CA(−37− 18ζ2)− 80CF ) TF + C2A ( −12ζ3 + 41 6 ζ2 + 3181 108 + ζ2 2 ξ + 137 36 ξ ) + CACF ( 16ζ3 − 1570 27 ) + 272 3 C2F } + nfTF { CA (56 9 ζ3 + 10 9 ζ2 −3203 243 ) + CF ( −20 3 ζ2 − 1942 81 )} + TF { CA ( −295 18 ζ3 + 35 9 ζ2 + 6361 486 ) +CF ( −7ζ3 − 16 3 ζ2 − 218 81 )} + C2A { 4B4 − 27ζ4 + 1969 72 ζ3 − 781 72 ζ2 + 42799 3888 − 7 6 ζ3ξ + 7 8 ζ2ξ + 3577 432 ξ } + CACF { −8B4 + 36ζ4 − 1957 12 ζ3 58 + 89 3 ζ2 + 10633 81 } + C2F { 95 3 ζ3 + 274 9 }) +O(ε) , (4.86) and for the quark self–energy, Σˆ(2)(0, mˆ 2 µ2 ) = TFCF (mˆ2 µ2 )ε{2 ε + 5 6 + [ 89 72 + ζ2 2 ] ε } +O(ε2) , (4.87) Σˆ(3)(0, mˆ 2 µ2 ) = TFCF (mˆ2 µ2 )3ε/2 ( 8 3ε3CA{1− ξ}+ 1 ε2 {32 9 TF (nf + 2)− CA (40 9 + 4ξ ) −8 3 CF } + 1 ε { 40 27 TF (nf + 2) + CA { ζ2 + 454 27 − ζ2ξ − 70 9 ξ } − 26CF } +nfTF {4 3 ζ2 + 674 81 } + TF {8 3 ζ2 + 604 81 } + CA {17 3 ζ3 − 5 3 ζ2 + 1879 162 + 7 3 ζ3ξ − 3 2 ζ2ξ − 407 27 ξ } + CF { −8ζ3 − ζ2 − 335 18 }) +O(ε) , (4.88) see also [263,278]. In Eq. (4.86) the constant B4 = −4ζ2 ln2(2) + 2 3 ln4(2)− 13 2 ζ4 + 16Li4 (1 2 ) ≈ −1.762800093... (4.89) appears due to genuine massive effects, cf. [279–282]. 4.7.2 ANSqq,Q The lowest non–trivial NS–contribution is of O(a2s), ANSqq,Q = 1 + a2sA (2),NS qq,Q + a3sA (3),NS qq,Q +O(a4s) . (4.90) The expansion coefficients are obtained in the MOM–scheme from the bare quantities, using Eqs. (4.57, 4.76). After mass– and coupling constant renormalization, the OMEs are given by A(2),NS,MOMqq,Q = Aˆ (2),NS,MOM qq,Q + Z−1,(2),NSqq (nf + 1)− Z−1,(2),NSqq (nf ) , (4.91) A(3),NS,MOMqq,Q = Aˆ (3),NS,MOM qq,Q + Z−1,(3),NSqq (nf + 1)− Z−1,(3),NSqq (nf ) +Z−1,(1),NSqq (nf + 1)Aˆ (2),NS,MOM qq,Q + [ Aˆ(2),NS,MOMqq,Q +Z−1,(2),NSqq (nf + 1)− Z−1,(2),NSqq (nf ) ] Γ−1,(1)qq (nf ) . (4.92) From (4.57, 4.76, 4.91, 4.92), one predicts the pole terms of the unrenormalized OME. At second and third order they read ˆˆA (2),NS qq,Q = (mˆ2 µ2 )ε ( β0,Qγ(0)qq ε2 + γˆ(1),NSqq 2ε + a (2),NS qq,Q + a (2),NS qq,Q ε ) , (4.93) ˆˆA (3),NS qq,Q = (mˆ2 µ2 )3ε/2 { −4γ (0) qq β0,Q 3ε3 ( β0 + 2β0,Q ) + 1 ε2 ( 2γ(1),NSqq β0,Q 3 − 4γˆ (1),NS qq 3 [ β0 + β0,Q ] + 2β1,Qγ(0)qq 3 − 2δm(−1)1 β0,Qγ(0)qq ) + 1 ε ( γˆ(2),NSqq 3 − 4a(2),NSqq,Q [ β0 + β0,Q ] + β(1)1,Qγ(0)qq 59 + γ(0)qq β0β0,Qζ2 2 − 2δm(0)1 β0,Qγ(0)qq − δm (−1) 1 γˆ(1),NSqq ) + a(3),NSqq,Q } . (4.94) Note, that we have already used the general structure of the unrenormalized lower order OME in the evaluation of the O(aˆ3s) term, as we will always do in the following. Using Eqs. (4.57, 4.91, 4.92), one can renormalize the above expressions. In addition, we finally transform back to the MS–scheme using Eq. (4.55). Thus one obtains the renormalized expansion coefficients of Eq. (4.90) A(2),NS,MSqq,Q = β0,Qγ(0)qq 4 ln2 (m2 µ2 ) + γˆ(1),NSqq 2 ln (m2 µ2 ) + a(2),NSqq,Q − β0,Qγ(0)qq 4 ζ2 , (4.95) A(3),NS,MSqq,Q = − γ(0)qq β0,Q 6 ( β0 + 2β0,Q ) ln3 (m2 µ2 ) + 1 4 { 2γ(1),NSqq β0,Q − 2γˆ(1),NSqq ( β0 + β0,Q ) +β1,Qγ(0)qq } ln2 (m2 µ2 ) + 1 2 { γˆ(2),NSqq − ( 4a(2),NSqq,Q − ζ2β0,Qγ(0)qq ) (β0 + β0,Q) +γ(0)qq β (1) 1,Q } ln (m2 µ2 ) + 4a(2),NSqq,Q (β0 + β0,Q)− γ(0)qq β (2) 1,Q − γ(0)qq β0β0,Qζ3 6 −γ (1),NS qq β0,Qζ2 4 + 2δm(1)1 β0,Qγ(0)qq + δm (0) 1 γˆ(1),NSqq + 2δm (−1) 1 a (2),NS qq,Q +a(3),NSqq,Q . (4.96) Note that in the NS–case, one is generically provided with even and odd moments due to a Ward–identity relating the results in the polarized and unpolarized case. The former refer to the anomalous dimensions γNS,+qq and the latter to γNS,−qq , respectively, as given in Eqs. (3.5, 3.7) and Eqs. (3.6, 3.8) in Ref. [124]. The relations above also apply to other twist–2 non–singlet massive OMEs, as to transversity, for which the 2- and 3–loop heavy flavor corrections are given in Section 9, cf. also [160]. 4.7.3 APSQq and APSqq,Q There are two different PS–contributions, cf. the discussion below Eq. 3.18, APSQq = a2sA (2),PS Qq + a3sA (3),PS Qq +O(a4s) , (4.97) APSqq,Q = a3sA (3),PS qq,Q +O(a4s) . (4.98) Separating these contributions is not straightforward, since the generic renormalization formula for operator renormalization and mass factorization, Eq. (4.76), applies to the sum of these terms only. At O(a2s), this problem does not occur and renormalization proceeds in the MOM–scheme via A(2),PS,MOMQq = Aˆ (2),PS,MOM Qq + Z−1,(2),PSqq (nf + 1)− Z−1,(2),PSqq (nf ) + [ Aˆ(1),MOMQg + Z−1,(1)qg (nf + 1)− Z−1,(1)qg (nf ) ] Γ−1,(1)gq (nf ) . (4.99) The unrenormalized expression is given by ˆˆA (2),PS Qq = (mˆ2 µ2 )ε ( − γˆ (0) qg γ(0)gq 2ε2 + γˆ(1),PSqq 2ε + a (2),PS Qq + a (2),PS Qq ε ) . (4.100) 60 The renormalized result in the MS–scheme reads A(2),PS,MSQq = − γˆ(0)qg γ(0)gq 8 ln2 (m2 µ2 ) + γˆ(1),PSqq 2 ln (m2 µ2 ) + a(2),PSQq + γˆ(0)qg γ(0)gq 8 ζ2 . (4.101) The corresponding renormalization relation at third order is given by A(3),PS,MOMQq + A (3),PS,MOM qq,Q = Aˆ (3),PS,MOM Qq + Aˆ (3),PS,MOM qq,Q + Z−1,(3),PSqq (nf + 1) − Z−1,(3),PSqq (nf ) + Z−1,(1)qq (nf + 1)Aˆ (2),PS,MOM Qq + Z−1,(1)qg (nf + 1)Aˆ (2),MOM gq,Q + [ Aˆ(1),MOMQg + Z−1,(1)qg (nf + 1)− Z−1,(1)qg (nf ) ] Γ−1,(2)gq (nf ) + [ Aˆ(2),PS,MOMQq + Z−1,(2),PSqq (nf + 1)− Z−1,(2),PSqq (nf ) ] Γ−1,(1)qq (nf ) + [ Aˆ(2),MOMQg + Z−1,(2)qg (nf + 1) − Z−1,(2)qg (nf ) + Z−1,(1)qq (nf + 1)A (1),MOM Qg + Z−1,(1)qg (nf + 1)A (1),MOM gg,Q ] Γ−1,(1)gq (nf ) . (4.102) Taking into account the structure of the UV– and collinear singularities of the contributing Feynman–diagrams, these two contributions can be separated. For the bare quantities we obtain ˆˆA (3),PS Qq = (mˆ2 µ2 )3ε/2 [ γˆ(0)qg γ(0)gq 6ε3 ( γ(0)gg − γ(0)qq + 6β0 + 16β0,Q ) + 1 ε2 ( −4γˆ (1),PS qq 3 [ β0 + β0,Q ] −γ (0) gq γˆ(1)qg 3 + γˆ(0)qg 6 [ 2γˆ(1)gq − γ(1)gq ] + δm(−1)1 γˆ(0)qg γ(0)gq ) + 1 ε ( γˆ(2),PSqq 3 − nf ˆ˜γ(2),PSqq 3 +γˆ(0)qg a (2) gq,Q − γ(0)gq a (2) Qg − 4(β0 + β0,Q)a (2),PS Qq − γˆ(0)qg γ(0)gq ζ2 16 [ γ(0)gg − γ(0)qq + 6β0 ] +δm(0)1 γˆ(0)qg γ(0)gq − δm (−1) 1 γˆ(1),PSqq ) + a(3),PSQq ] , (4.103) ˆˆA (3),PS qq,Q = nf (mˆ2 µ2 )3ε/2 [ 2γˆ(0)qg γ(0)gq β0,Q 3ε3 + 1 3ε2 ( 2γˆ(1),PSqq β0,Q + γˆ(0)qg γˆ(1)gq ) + 1 ε ( ˆ˜γ(2),PSqq 3 + γˆ(0)qg a (2) gq,Q − γˆ(0)qg γ(0)gq β0,Qζ2 4 ) + a(3),PSqq,Q nf ] . (4.104) The renormalized terms in the MS–scheme are given by A(3),PS,MSQq = γˆ(0)qg γ(0)gq 48 { γ(0)gg − γ(0)qq + 6β0 + 16β0,Q } ln3 (m2 µ2 ) + 1 8 { −4γˆ(1),PSqq ( β0 + β0,Q ) +γˆ(0)qg ( γˆ(1)gq − γ(1)gq ) − γ(0)gq γˆ(1)qg } ln2 (m2 µ2 ) + 1 16 { 8γˆ(2),PSqq − 8nf ˆ˜γ (2),PS qq −32a(2),PSQq (β0 + β0,Q) + 8γˆ(0)qg a (2) gq,Q − 8γ(0)gq a (2) Qg − γˆ(0)qg γ(0)gq ζ2 ( γ(0)gg − γ(0)qq +6β0 + 8β0,Q )} ln (m2 µ2 ) + 4(β0 + β0,Q)a(2),PSQq + γ(0)gq a (2) Qg − γˆ(0)qg a (2) gq,Q + γ(0)gq γˆ(0)qg ζ3 48 ( γ(0)gg − γ(0)qq + 6β0 ) + γˆ(0)qg γ(1)gq ζ2 16 − δm(1)1 γˆ(0)qg γ(0)gq + δm (0) 1 γˆ(1),PSqq 61 +2δm(−1)1 a (2),PS Qq + a (3),PS Qq . (4.105) A(3),PS,MSqq,Q = nf { γ(0)gq γˆ(0)qg β0,Q 12 ln3 (m2 µ2 ) + 1 8 ( 4γˆ(1),PSqq β0,Q + γˆ(0)qg γˆ(1)gq ) ln2 (m2 µ2 ) + 1 4 ( 2ˆ˜γ(2),PSqq + γˆ(0)qg { 2a(2)gq,Q − γ(0)gq β0,Qζ2 }) ln (m2 µ2 ) −γˆ(0)qg a (2) gq,Q + γ(0)gq γˆ(0)qg β0,Qζ3 12 − γˆ (1),PS qq β0,Qζ2 4 } + a(3),PSqq,Q . (4.106) 4.7.4 AQg and Aqg,Q The OME AQg is the most complex expression. As in the PS–case, there are two different contributions AQg = asA(1)Qg + a2sA (2) Qg + a3sA (3) Qg +O(a4s) . (4.107) Aqg,Q = a3sA (3) qg,Q +O(a4s) . (4.108) In the MOM–scheme the 1– and 2–loop contributions obey the following relations A(1),MOMQg = Aˆ (1),MOM Qg + Z−1,(1)qg (nf + 1)− Z−1,(1)qg (nf ) , (4.109) A(2),MOMQg = Aˆ (2),MOM Qg + Z−1,(2)qg (nf + 1)− Z−1,(2)qg (nf ) + Z−1,(1)qg (nf + 1)Aˆ (1),MOM gg,Q +Z−1,(1)qq (nf + 1)Aˆ (1),MOM Qg + [ Aˆ(1),MOMQg + Z−1,(1)qg (nf + 1) −Z−1,(1)qg (nf ) ] Γ−1,(1)gg (nf ) . (4.110) The unrenormalized terms are given by ˆˆA (1) Qg = (mˆ2 µ2 )ε/2 γˆ(0)qg ε exp ( ∞∑ i=2 ζi i (ε 2 )i) , (4.111) ˆˆA (2) Qg = (mˆ2 µ2 )ε [ − γˆ (0) qg 2ε2 ( γ(0)gg − γ(0)qq + 2β0 + 4β0,Q ) + γˆ(1)qg − 2δm(−1)1 γˆ (0) qg 2ε + a (2) Qg −δm(0)1 γˆ(0)qg − γˆ(0)qg β0,Qζ2 2 + ε ( a(2)Qg − δm (1) 1 γˆ(0)qg − γˆ(0)qg β0,Qζ2 12 )] . (4.112) Note that we have already made the one–particle reducible contributions to Eq. (4.112) explicit, which are given by the LO–term multiplied with the 1–loop gluon–self energy, cf. Eq. (4.84). Furthermore, Eq. (4.112) already contains terms in the O(ε0) and O(ε) expressions which result from mass renormalization. At this stage of the renormalization procedure they should not be present, however, we have included them here in order to have the same notation as in Refs. [126,129] at the 2–loop level. The renormalized terms then become in the MS–scheme A(1),MSQg = γˆ(0)qg 2 ln (m2 µ2 ) , (4.113) A(2),MSQg = − γˆ(0)qg 8 [ γ(0)gg − γ(0)qq + 2β0 + 4β0,Q ] ln2 (m2 µ2 ) + γˆ(1)qg 2 ln (m2 µ2 ) 62 +a(2)Qg + γˆ(0)qg ζ2 8 ( γ(0)gg − γ(0)qq + 2β0 ) . (4.114) The generic renormalization relation at the 3–loop level is given by A(3),MOMQg + A (3),MOM qg,Q = Aˆ (3),MOM Qg + Aˆ (3),MOM qg,Q + Z−1,(3)qg (nf + 1)− Z−1,(3)qg (nf ) + Z−1,(2)qg (nf + 1)Aˆ (1),MOM gg,Q + Z−1,(1)qg (nf + 1)Aˆ (2),MOM gg,Q + Z−1,(2)qq (nf + 1)Aˆ (1),MOM Qg + Z−1,(1)qq (nf + 1)Aˆ (2),MOM Qg + [ Aˆ(1),MOMQg + Z−1,(1)qg (nf + 1) − Z−1,(1)qg (nf ) ] Γ−1,(2)gg (nf ) + [ Aˆ(2),MOMQg + Z−1,(2)qg (nf + 1)− Z−1,(2)qg (nf ) + Z−1,(1)qq (nf + 1)A (1),MOM Qg + Z−1,(1)qg (nf + 1)A (1),MOM gg,Q ] Γ−1,(1)gg (nf ) + [ Aˆ(2),PS,MOMQq + Z−1,(2),PSqq (nf + 1)− Z−1,(2),PSqq (nf ) ] Γ−1,(1)qg (nf ) + [ Aˆ(2),NS,MOMqq,Q + Z−1,(2),NSqq (nf + 1)− Z−1,(2),NSqq (nf ) ] Γ−1,(1)qg (nf ) . (4.115) Similar to the PS–case, the different contributions can be separated and one obtains the following unrenormalized results ˆˆA (3) Qg = (mˆ2 µ2 )3ε/2 [ γˆ(0)qg 6ε3 ( (nf + 1)γ(0)gq γˆ(0)qg + γ(0)qq [ γ(0)qq − 2γ(0)gg − 6β0 − 8β0,Q ] + 8β20 +28β0,Qβ0 + 24β20,Q + γ(0)gg [ γ(0)gg + 6β0 + 14β0,Q ]) + 1 6ε2 ( γˆ(1)qg [ 2γ(0)qq − 2γ(0)gg −8β0 − 10β0,Q ] + γˆ(0)qg [ γˆ(1),PSqq {1− 2nf}+ γ(1),NSqq + γˆ(1),NSqq + 2γˆ(1)gg − γ(1)gg − 2β1 −2β1,Q ] + 6δm(−1)1 γˆ(0)qg [ γ(0)gg − γ(0)qq + 3β0 + 5β0,Q ]) + 1 ε ( γˆ(2)qg 3 − nf ˆ˜γ(2)qg 3 +γˆ(0)qg [ a(2)gg,Q − nfa (2),PS Qq ] + a(2)Qg [ γ(0)qq − γ(0)gg − 4β0 − 4β0,Q ] + γˆ(0)qg ζ2 16 [ γ(0)gg { 2γ(0)qq −γ(0)gg − 6β0 + 2β0,Q } − (nf + 1)γ(0)gq γˆ(0)qg + γ(0)qq { −γ(0)qq + 6β0 } − 8β20 +4β0,Qβ0 + 24β20,Q ] + δm(−1)1 2 [ −2γˆ(1)qg + 3δm (−1) 1 γˆ(0)qg + 2δm (0) 1 γˆ(0)qg ] +δm(0)1 γˆ(0)qg [ γ(0)gg − γ(0)qq + 2β0 + 4β0,Q ] − δm(−1)2 γˆ(0)qg ) + a(3)Qg ] . (4.116) ˆˆA (3) qg,Q = nf (mˆ2 µ2 )3ε/2 [ γˆ(0)qg 6ε3 ( γ(0)gq γˆ(0)qg + 2β0,Q [ γ(0)gg − γ(0)qq + 2β0 ]) + 1 ε2 ( γˆ(0)qg 6 [ 2γˆ(1)gg +γˆ(1),PSqq − 2γˆ(1),NSqq + 4β1,Q ] + γˆ(1)qg β0,Q 3 ) + 1 ε ( ˆ˜γ(2)qg 3 + γˆ(0)qg [ a(2)gg,Q − a (2),NS qq,Q +β(1)1,Q ] − γˆ (0) qg ζ2 16 [ γ(0)gq γˆ(0)qg + 2β0,Q { γ(0)gg − γ(0)qq + 2β0 }]) + a(3)qg,Q nf ] . (4.117) 63 The renormalized expressions are A(3),MSQg = γˆ(0)qg 48 { (nf + 1)γ(0)gq γˆ(0)qg + γ(0)gg ( γ(0)gg − 2γ(0)qq + 6β0 + 14β0,Q ) + γ(0)qq ( γ(0)qq −6β0 − 8β0,Q ) + 8β20 + 28β0,Qβ0 + 24β20,Q } ln3 (m2 µ2 ) + 1 8 { γˆ(1)qg ( γ(0)qq − γ(0)gg −4β0 − 6β0,Q ) + γˆ(0)qg ( γˆ(1)gg − γ(1)gg + (1− nf )γˆ(1),PSqq + γ(1),NSqq + γˆ(1),NSqq − 2β1 −2β1,Q )} ln2 (m2 µ2 ) + { γˆ(2)qg 2 − nf ˆ˜γ(2)qg 2 + a(2)Qg 2 ( γ(0)qq − γ(0)gg − 4β0 − 4β0,Q ) + γˆ(0)qg 2 ( a(2)gg,Q − nfa (2),PS Qq ) + γˆ(0)qg ζ2 16 ( −(nf + 1)γ(0)gq γˆ(0)qg + γ(0)gg [ 2γ(0)qq − γ(0)gg − 6β0 −6β0,Q ] − 4β0[2β0 + 3β0,Q] + γ(0)qq [ −γ(0)qq + 6β0 + 4β0,Q ])} ln (m2 µ2 ) + a(2)Qg ( γ(0)gg −γ(0)qq + 4β0 + 4β0,Q ) + γˆ(0)qg ( nfa(2),PSQq − a (2) gg,Q ) + γˆ(0)qg ζ3 48 ( (nf + 1)γ(0)gq γˆ(0)qg +γ(0)gg [ γ(0)gg − 2γ(0)qq + 6β0 − 2β0,Q ] + γ(0)qq [ γ(0)qq − 6β0 ] + 8β20 − 4β0β0,Q −24β20,Q ) + γˆ(1)qg β0,Qζ2 8 + γˆ(0)qg ζ2 16 ( γ(1)gg − γˆ(1),NSqq − γ(1),NSqq − γˆ(1),PSqq + 2β1 +2β1,Q ) + δm(−1)1 8 ( 16a(2)Qg + γˆ(0)qg [ −24δm(0)1 − 8δm (1) 1 − ζ2β0 − 9ζ2β0,Q ]) + δm(0)1 2 ( 2γˆ(1)qg − δm (0) 1 γˆ(0)qg ) + δm(1)1 γˆ(0)qg ( γ(0)qq − γ(0)gg − 2β0 − 4β0,Q ) +δm(0)2 γˆ(0)qg + a (3) Qg . (4.118) A(3),MSqg,Q = nf [ γˆ(0)qg 48 { γ(0)gq γˆ(0)qg + 2β0,Q ( γ(0)gg − γ(0)qq + 2β0 )} ln3 (m2 µ2 ) + 1 8 { 2γˆ(1)qg β0,Q +γˆ(0)qg ( γˆ(1),PSqq − γˆ(1),NSqq + γˆ(1)gg + 2β1,Q )} ln2 (m2 µ2 ) + 1 2 { ˆ˜γ(2)qg + γˆ(0)qg ( a(2)gg,Q −a(2),NSqq,Q + β (1) 1,Q ) − γˆ (0) qg 8 ζ2 ( γ(0)gq γˆ(0)qg + 2β0,Q [ γ(0)gg − γ(0)qq + 2β0 ])} ln (m2 µ2 ) +γˆ(0)qg ( a(2),NSqq,Q − a (2) gg,Q − β (2) 1,Q ) + γˆ(0)qg 48 ζ3 ( γ(0)gq γˆ(0)qg + 2β0,Q [ γ(0)gg − γ(0)qq + 2β0 ]) − ζ2 16 ( γˆ(0)qg γˆ(1),PSqq + 2γˆ(1)qg β0,Q ) + a(3)qg,Q nf ] . (4.119) 4.7.5 Agq,Q The gq–contributions start at O(a2s), Agq,Q = a2sA (2) gq,Q + a3sA (3) gq,Q +O(a4s) . (4.120) 64 The renormalization formulas in the MOM–scheme read A(2),MOMgq,Q = Aˆ (2),MOM gq,Q + Z−1,(2)gq (nf + 1)− Z−1,(2)gq (nf ) + ( Aˆ(1),MOMgg,Q + Z−1,(1)gg (nf + 1)− Z−1,(1)gg (nf ) ) Γ−1,(1)gq , (4.121) A(3),MOMgq,Q = Aˆ (3),MOM gq,Q + Z−1,(3)gq (nf + 1)− Z−1,(3)gq (nf ) + Z−1,(1)gg (nf + 1)Aˆ (2),MOM gq,Q +Z−1,(1)gq (nf + 1)Aˆ(2),MOMqq + [ Aˆ(1),MOMgg,Q + Z−1,(1)gg (nf + 1) −Z−1,(1)gg (nf ) ] Γ−1,(2)gq (nf ) + [ Aˆ(2),MOMgq,Q + Z−1,(2)gq (nf + 1) −Z−1,(2)gq (nf ) ] Γ−1,(1)qq (nf ) + [ Aˆ(2),MOMgg,Q + Z−1,(2)gg (nf + 1) −Z−1,(2)gg (nf ) + Z−1,(1)gg (nf + 1)Aˆ (1),MOM gg,Q +Z−1,(1)gq (nf + 1)Aˆ (1),MOM Qg ] Γ−1,(1)gq (nf ) , (4.122) while the unrenormalized expressions are ˆˆA (2) gq,Q = (mˆ2 µ2 )ε [ 2β0,Q ε2 γ (0) gq + γˆ(1)gq 2ε + a (2) gq,Q + a (2) gq,Qε ] , (4.123) ˆˆA (3) gq,Q = (mˆ2 µ2 )3ε/2 { −γ (0) gq 3ε3 ( γ(0)gq γˆ(0)qg + [ γ(0)qq − γ(0)gg + 10β0 + 24β0,Q ] β0,Q ) + 1 ε2 ( γ(1)gq β0,Q + γˆ(1)gq 3 [ γ(0)gg − γ(0)qq − 4β0 − 6β0,Q ] + γ(0)gq 3 [ γˆ(1),NSqq + γˆ(1),PSqq − γˆ(1)gg +2β1,Q ] − 4δm(−1)1 β0,Qγ(0)gq ) + 1 ε ( γˆ(2)gq 3 + a(2)gq,Q [ γ(0)gg − γ(0)qq − 6β0,Q − 4β0 ] +γ(0)gq [ a(2),NSqq,Q + a (2),PS Qq − a (2) gg,Q ] + γ(0)gq β (1) 1,Q + γ(0)gq ζ2 8 [ γ(0)gq γˆ(0)qg + β0,Q(γ(0)qq −γ(0)gg + 10β0) ] − δm(−1)1 γˆ(1)gq − 4δm (0) 1 β0,Qγ(0)gq ) + a(3)gq,Q } . (4.124) The contributions to the renormalized operator matrix element are given by A(2),MSgq,Q = β0,Qγ(0)gq 2 ln2 (m2 µ2 ) + γˆ(1)gq 2 ln (m2 µ2 ) + a(2)gq,Q − β0,Qγ(0)gq 2 ζ2 , (4.125) A(3),MSgq,Q = − γ(0)gq 24 { γ(0)gq γˆ(0)qg + ( γ(0)qq − γ(0)gg + 10β0 + 24β0,Q ) β0,Q } ln3 (m2 µ2 ) + 1 8 { 6γ(1)gq β0,Q + γˆ(1)gq ( γ(0)gg − γ(0)qq − 4β0 − 6β0,Q ) + γ(0)gq ( γˆ(1),NSqq + γˆ(1),PSqq −γˆ(1)gg + 2β1,Q )} ln2 (m2 µ2 ) + 1 8 { 4γˆ(2)gq + 4a (2) gq,Q ( γ(0)gg − γ(0)qq − 4β0 −6β0,Q ) + 4γ(0)gq ( a(2),NSqq,Q + a (2),PS Qq − a (2) gg,Q + β (1) 1,Q ) + γ(0)gq ζ2 ( γ(0)gq γˆ(0)qg + [ γ(0)qq 65 −γ(0)gg + 12β0,Q + 10β0 ] β0,Q )} ln (m2 µ2 ) + a(2)gq,Q ( γ(0)qq − γ(0)gg + 4β0 + 6β0,Q ) +γ(0)gq ( a(2)gg,Q − a (2),PS Qq − a (2),NS qq,Q ) − γ(0)gq β (2) 1,Q − γ(0)gq ζ3 24 ( γ(0)gq γˆ(0)qg + [ γ(0)qq − γ(0)gg +10β0 ] β0,Q ) − 3γ (1) gq β0,Qζ2 8 + 2δm(−1)1 a (2) gq,Q + δm (0) 1 γˆ(1)gq + 4δm (1) 1 β0,Qγ(0)gq + a (3) gq,Q . (4.126) 4.7.6 Agg,Q The gg–contributions start at O(a0s), Agg,Q = 1 + asA(1)gg,Q + a2sA (2) gg,Q + a3sA (3) gg,Q +O(a4s) . (4.127) The corresponding renormalization formulas read in the MOM–scheme A(1),MOMgg,Q = Aˆ (1),MOM gg,Q + Z−1,(1)gg (nf + 1)− Z−1,(1)gg (nf ) , (4.128) A(2),MOMgg,Q = Aˆ (2),MOM gg,Q + Z−1,(2)gg (nf + 1)− Z−1,(2)gg (nf ) +Z−1,(1)gg (nf + 1)Aˆ (1),MOM gg,Q + Z−1,(1)gq (nf + 1)Aˆ (1),MOM Qg + [ Aˆ(1),MOMgg,Q + Z−1,(1)gg (nf + 1)− Z−1,(1)gg (nf ) ] Γ−1,(1)gg (nf ) , (4.129) A(3),MOMgg,Q = Aˆ (3),MOM gg,Q + Z−1,(3)gg (nf + 1)− Z−1,(3)gg (nf ) + Z−1,(2)gg (nf + 1)Aˆ (1),MOM gg,Q +Z−1,(1)gg (nf + 1)Aˆ (2),MOM gg,Q + Z−1,(2)gq (nf + 1)Aˆ (1),MOM Qg +Z−1,(1)gq (nf + 1)Aˆ (2),MOM Qg + [ Aˆ(1),MOMgg,Q + Z−1,(1)gg (nf + 1) −Z−1,(1)gg (nf ) ] Γ−1,(2)gg (nf ) + [ Aˆ(2),MOMgg,Q + Z−1,(2)gg (nf + 1) −Z−1,(2)gg (nf ) + Z−1,(1)gq (nf + 1)A (1),MOM Qg +Z−1,(1)gg (nf + 1)A (1),MOM gg,Q ] Γ−1,(1)gg (nf ) + [ Aˆ(2),MOMgq,Q + Z−1,(2)gq (nf + 1)− Z−1,(2)gq (nf ) ] Γ−1,(1)qg (nf ) . (4.130) The general structure of the unrenormalized 1–loop result is then given by ˆˆA (1) gg,Q = (mˆ2 µ2 )ε/2 ( γˆ(0)gg ε + a (1) gg,Q + εa (1) gg,Q + ε2a (1) gg,Q ) . (4.131) One obtains ˆˆA (1) gg,Q = (mˆ2 µ2 )ε/2( −2β0,Qε ) exp ( ∞∑ i=2 ζi i (ε 2 )i) . (4.132) Using Eq. (4.132), the 2–loop term is given by ˆˆA (2) gg,Q = (mˆ2 µ2 )ε [ 1 2ε2 { γ(0)gq γˆ(0)qg + 2β0,Q ( γ(0)gg + 2β0 + 4β0,Q )} + γˆ(1)gg + 4δm(−1)1 β0,Q 2ε +a(2)gg,Q + 2δm (0) 1 β0,Q + β20,Qζ2 + ε [ a(2)gg,Q + 2δm (1) 1 β0,Q + β20,Qζ3 6 ]] . (4.133) 66 Again, we have made explicit one–particle reducible contributions and terms stemming from mass renormalization in order to refer to the notation of Refs. [126, 129], cf. the discussion below (4.112). The 3–loop contribution becomes ˆˆA (3) gg,Q = (mˆ2 µ2 )3ε/2 [ 1 ε3 ( −γ (0) gq γˆ(0)qg 6 [ γ(0)gg − γ(0)qq + 6β0 + 4nfβ0,Q + 10β0,Q ] −2γ (0) gg β0,Q 3 [ 2β0 + 7β0,Q ] − 4β0,Q 3 [ 2β20 + 7β0,Qβ0 + 6β20,Q ]) + 1 ε2 ( γˆ(0)qg 6 [ γ(1)gq − (2nf − 1)γˆ(1)gq ] + γ(0)gq γˆ(1)qg 3 − γˆ (1) gg 3 [ 4β0 + 7β0,Q ] + 2β0,Q 3 [ γ(1)gg + β1 + β1,Q ] + 2γ(0)gg β1,Q 3 + δm(−1)1 [ −γˆ(0)qg γ(0)gq − 2β0,Qγ(0)gg −10β20,Q − 6β0,Qβ0 ]) + 1 ε ( γˆ(2)gg 3 − 2(2β0 + 3β0,Q)a(2)gg,Q − nf γˆ(0)qg a (2) gq,Q +γ(0)gq a (2) Qg + β (1) 1,Qγ(0)gg + γ(0)gq γˆ(0)qg ζ2 16 [ γ(0)gg − γ(0)qq + 2(2nf + 1)β0,Q + 6β0 ] + β0,Qζ2 4 [ γ(0)gg {2β0 − β0,Q}+ 4β20 − 2β0,Qβ0 − 12β20,Q ] +δm(−1)1 [ −3δm(−1)1 β0,Q − 2δm (0) 1 β0,Q − γˆ(1)gg ] + δm(0)1 [ −γˆ(0)qg γ(0)gq −2γ(0)gg β0,Q − 4β0,Qβ0 − 8β20,Q ] + 2δm(−1)2 β0,Q ) + a(3)gg,Q ] . (4.134) The renormalized results are A(1),MSgg,Q = −β0,Q ln (m2 µ2 ) , (4.135) A(2),MSgg,Q = 1 8 { 2β0,Q ( γ(0)gg + 2β0 ) + γ(0)gq γˆ(0)qg + 8β20,Q } ln2 (m2 µ2 ) + γˆ(1)gg 2 ln (m2 µ2 ) −ζ2 8 [ 2β0,Q ( γ(0)gg + 2β0 ) + γ(0)gq γˆ(0)qg ] + a(2)gg,Q , (4.136) A(3),MSgg,Q = 1 48 { γ(0)gq γˆ(0)qg ( γ(0)qq − γ(0)gg − 6β0 − 4nfβ0,Q − 10β0,Q ) − 4 ( γ(0)gg [ 2β0 + 7β0,Q ] +4β20 + 14β0,Qβ0 + 12β20,Q ) β0,Q } ln3 (m2 µ2 ) + 1 8 { γˆ(0)qg ( γ(1)gq + (1− nf )γˆ(1)gq ) +γ(0)gq γˆ(1)qg + 4γ(1)gg β0,Q − 4γˆ(1)gg [β0 + 2β0,Q] + 4[β1 + β1,Q]β0,Q +2γ(0)gg β1,Q } ln2 (m2 µ2 ) + 1 16 { 8γˆ(2)gg − 8nfa (2) gq,Qγˆ(0)qg − 16a (2) gg,Q(2β0 + 3β0,Q) +8γ(0)gq a (2) Qg + 8γ(0)gg β (1) 1,Q + γ(0)gq γˆ(0)qg ζ2 ( γ(0)gg − γ(0)qq + 6β0 + 4nfβ0,Q + 6β0,Q ) +4β0,Qζ2 ( γ(0)gg + 2β0 )( 2β0 + 3β0,Q )} ln (m2 µ2 ) + 2(2β0 + 3β0,Q)a(2)gg,Q 67 +nf γˆ(0)qg a (2) gq,Q − γ(0)gq a (2) Qg − β (2) 1,Qγ(0)gg + γ(0)gq γˆ(0)qg ζ3 48 ( γ(0)qq − γ(0)gg − 2[2nf + 1]β0,Q −6β0 ) + β0,Qζ3 12 ( [β0,Q − 2β0]γ(0)gg + 2[β0 + 6β0,Q]β0,Q − 4β20 ) − γˆ (0) qg ζ2 16 ( γ(1)gq + γˆ(1)gq ) + β0,Qζ2 8 ( γˆ(1)gg − 2γ(1)gg − 2β1 − 2β1,Q ) + δm(−1)1 4 ( 8a(2)gg,Q +24δm(0)1 β0,Q + 8δm (1) 1 β0,Q + ζ2β0,Qβ0 + 9ζ2β20,Q ) + δm(0)1 ( β0,Qδm(0)1 + γˆ(1)gg ) +δm(1)1 ( γˆ(0)qg γ(0)gq + 2β0,Qγ(0)gg + 4β0,Qβ0 + 8β20,Q ) − 2δm(0)2 β0,Q + a (3) gg,Q . (4.137) 68 5 Representation in Different Renormalization Schemes As outlined in Section 4, there are different obvious possibilities to choose a scheme for the renormalization of the mass and the coupling constant. Concerning the coupling constant, we intermediately worked in a MOM–scheme, which derives from the condition that the external gluon lines have to be kept on–shell. In the end, we transformed back to the MS–description via. Eq. (4.55), since this is the commonly used renormalization scheme. If masses are involved, it is useful to renormalize them in the on–mass–shell–scheme, as it was done in the previous Section. In this scheme, one defines the renormalized mass m as the pole of the quark propagator. In this Section, we present the relations required to transform the renormalized results from Section 4.7 into the different, related schemes. In Section 5.1, we show how these scheme transformations affect the NLO results. Denoting the MS–mass by m, there are in addition to the {aMS, m}–scheme adopted in Section 4.7 the following schemes { aMOMs , m } , { aMOMs , m } , { aMSs , m } . (5.1) In case of mass renormalization in the MS–scheme, Eq. (4.27) becomes mˆ = ZMSm m = m [ 1 + aˆsδm1 + aˆ2sδm2 ] +O(aˆ3s) . (5.2) The corresponding coefficients read, [271], δm1 = 6 εCF ≡ δm(−1)1 ε , (5.3) δm2 = CF ε2 (18CF − 22CA + 8TF (nf + 1)) + CF ε ( 3 2 CF + 97 6 CA − 10 3 TF (nf + 1) ) ≡ δm (−2) 2 ε2 + δm(−1)2 ε . (5.4) One notices that the following relations hold between the expansion coefficients in ε of the on–shell– and MS–terms δm(−1)1 = δm (−1) 1 , (5.5) δm(−2)2 = δm (−2) 2 , (5.6) δm(−1)2 = δm (−1) 2 − δm (−1) 1 δm (0) 1 + 2δm (0) 1 (β0 + β0,Q) . (5.7) One has to be careful, since the choice of this scheme also affects the renormalization constant of the coupling in the MOM–scheme. This is due to the fact that in Eq. (4.42) mass renormalization had been performed in the on–shell–scheme. Going through the same steps as in Eqs. (4.42)–(4.47), but using the MS–mass, we obtain for Zg in the MOM–scheme. ZMOMg 2(ε, nf + 1, µ2,m2) = 1 + aMOMs (µ2) [2 ε (β0(nf ) + β0,Qf(ε)) ] +aMOMs 2(µ2) [β1(nf ) ε + 4 ε2 (β0(nf ) + β0,Qf(ε)) 2 + 2β0,Q ε δm (−1) 1 f(ε) + 1 ε (m2 µ2 )ε( β1,Q + εβ (1) 1,Q + ε2β (2) 1,Q )] +O(aMOMs 3) , (5.8) 69 where in the term f(ε), cf. Eq. (4.44), the MS–mass has to be used. The coefficients differing from the on–shell–scheme in the above equation are given by, cf. Eqs. (4.50, 4.51) β1,Q = β1,Q − 2β0,Qδm(−1)1 , (5.9) β(1)1,Q = β (1) 1,Q − 2β0,Qδm (0) 1 , (5.10) β(2)1,Q = β (2) 1,Q − β0,Q 4 ( 8δm(1)1 + δm (−1) 1 ζ2 ) . (5.11) The transformation formulas between the different schemes follow from the condition that the unrenormalized terms are equal. In order to transform from the {aMSs , m}–scheme to the {aMOMs , m}–scheme, the inverse of Eq. (4.55) aMSs (m2) = aMOMs [ 1 + β0,Q ln (m2 µ2 ) aMOMs + { β20,Q ln2 (m2 µ2 ) + β1,Q ln (m2 µ2 ) + β(1)1,Q } aMOMs 2 ] (5.12) is used. For the transformation to the {aMSs , m}–scheme one obtains m(aMSs ) = m(aMSs ) ( 1 + { −δm (−1) 1 2 ln (m2 µ2 ) − δm(0)1 } aMSs + { δm(−1)1 8 [ 2β0 + 2β0,Q + δm(−1)1 ] ln2 (m2 µ2 ) + 1 2 [ −δm(0)1 ( 2β0 + 2β0,Q −3δm(−1)1 ) + δm(−1)1 2 − 2δm(−1)2 ] ln (m2 µ2 ) + δm(1)1 [ δm(−1)1 − 2β0 − 2β0,Q ] +δm(0)1 [ δm(−1)1 + δm (0) 1 ] − δm(0)2 } aMSs 2 ) . (5.13) Finally, the transformation to the {aMOMs , m} is achieved via aMSs (m2) = aMOMs [ 1 + β0,Q ln (m2 µ2 ) aMOMs + { β20,Q ln2 (m2 µ2 ) + ( β1,Q − β0,Qδm(−1)1 ) ln (m2 µ2 ) + β(1)1,Q − 2δm (0) 1 β0,Q } aMOMs 2 ] , (5.14) and m(aMSs ) = m(aMOMs ) ( 1 + { −δm (−1) 1 2 ln (m2 µ2 ) − δm(0)1 } aMOMs + { δm(−1)1 8 [ 2β0 − 2β0,Q + δm(−1)1 ] ln2 (m2 µ2 ) + 1 2 [ −δm(0)1 ( 2β0 + 4β0,Q −3δm(−1)1 ) + δm(−1)1 2 − 2δm(−1)2 ] ln (m2 µ2 ) + δm(1)1 [ δm(−1)1 − 2β0 − 2β0,Q ] +δm(0)1 [ δm(−1)1 + δm (0) 1 ] − δm(0)2 } aMOMs 2 ) . (5.15) 70 The expressions for the OMEs in different schemes are then obtained by inserting the relations (5.12)–(5.15) into the general expression (4.77) and expanding in the coupling constant. 5.1 Scheme Dependence at NLO Finally, we would like to comment on how the factorization formulas for the heavy flavor Wilson coefficients, (3.26)–(3.30), have to be applied to obtain a complete description. Here, the renormalization of the coupling constant has to be carried out in the same way for all quantities contributing. The general factorization formula (3.16) holds only for completely inclusive quantities, including radiative corrections containing heavy quark loops, [129]. One has to distinguish one-particle irreducible and reducible diagrams, which both contribute in the calculation. We would like to remind the reader of the background of this aspect. If one evaluates the heavy-quark Wilson coefficients, diagrams of the type shown in Figure 7 may appear as well. Diagram (a) contains a virtual heavy quark loop correction to the gluon propagator in the initial state and contributes to the terms Lg,i and Hg,i, respectively, depending on whether a light or heavy quark pair is produced in the final state. Diagrams (b), (c) contribute to LNSq,i and contain radiative corrections to the gluon propagator due to heavy quarks as well. The latter diagrams contribute to F(2,L)(x,Q2) in the inclusive case, but are absent in the semi–inclusive QQ–production cross section. The same holds for diagram (a) if a qq–pair is produced. In Refs. [103], the Q(Q) Q(q) Q(q) (a) q(q) Q(Q) (b) q(q) Q(Q) (c) Figure 7: O(a2s) virtual heavy quark corrections. coupling constant was renormalized in the MOM–scheme by absorbing the contributions of diagram (a) into the coupling constant, as a consequence of which the term Lg,i appears for the first time at O(a3s). This can be made explicit by considering the complete gluonic Wilson coefficient up to O(a2s), including one heavy quark, cf. Eqs. (3.28, 3.30), Cg,(2,L)(nf ) + Lg,(2,L)(nf + 1) +Hg,(2,L)(nf + 1) = aMSs [ A(1),MSQg δ2 + C (1) g,(2,L)(nf + 1) ] +aMSs 2[ A(2),MSQg δ2 + A (1),MS Qg C (1),NS q,(2,L)(nf + 1) +A (1),MS gg,Q C (1) g,(2,L)(nf + 1) +C(2)g,(2,L)(nf + 1) ] . (5.16) 71 The above equation is given in the MS–scheme, and the structure of the OMEs can be inferred from Eqs. (4.113, 4.114). Here, diagram (a) gives a contribution, correspond- ing exactly to the color factor T 2F . The transformation to the MOM–scheme for as, cf. Eqs. (4.55, 4.56), yields Cg,(2,L)(nf ) + Lg,(2,L)(nf + 1) +Hg,(2,L)(nf + 1) = aMOMs [ A(1),MSQg δ2 + C (1) g,(2,L)(nf + 1) ] +aMOMs 2 [ A(2),MSQg δ2 + β0,Q ln (m2 µ2 ) A(1),MSQg δ2 + A (1),MS Qg C (1),NS q,(2,L)(nf + 1) +A(1),MSgg,Q C (1) g,(2,L)(nf + 1) + β0,Q ln (m2 µ2 ) C(1)g,(2,L)(nf + 1) + C (2) g,(2,L)(nf + 1) ] . (5.17) By using the general structure of the renormalized OMEs, Eqs. (4.113, 4.114, 4.135), one notices that all contributions due to diagram (a) cancel in the MOM–scheme, i.e., the color factor T 2F does not occur at the 2–loop level. Thus the factorization formula reads Cg,(2,L)(nf ) + Lg,(2,L)(nf + 1) +Hg,(2,L)(nf + 1) = aMOMs [ A(1),MOMQg δ2 + C (1) g,(2,L)(nf + 1) ] +aMOMs 2 [ A(2),MOMQg δ2 + A (1),MOM Qg C (1),NS q,(2,L)(nf + 1) + C (2) g,(2,L)(nf + 1) ] . (5.18) Splitting up Eq. (5.18) into Hg,i and Lg,i, one observes that Lg,i vanishes at O(a2s) and the term Hg,i is the one calculated in Ref. [126]. This is the asymptotic expression of the gluonic heavy flavor Wilson coefficient as calculated in Refs. [103]. Note that the observed cancellation was due to the fact that the term A(1)gg,Q receives only contributions from the heavy quark loops of the gluon–self energy, which also enters into the definition of the MOM–scheme. It is not clear whether this can be achieved at the 3–loop level as well, i.e., transforming the general inclusive factorization formula (3.16) in such a way that only the contributions due to heavy flavors in the final state remain. Therefore one should use these asymptotic expressions only for completely inclusive analyzes, where heavy and light flavors are treated together. This approach has also been adopted in Ref. [129] for the renormalization of the massive OMEs, which was performed in the MS–scheme and not in the MOM–scheme, as previously in Ref. [126]. The radiative corrections in the NS–case can be treated in the same manner. Here the scheme transformation affects only the light Wilson coefficients and not the OMEs at the 2–loop level. In the MS–scheme, one obtains the following asymptotic expression up to O(a2s) from Eqs. (3.21, 3.26). CNSq,(2,L)(nf ) + LNSq,(2,L)(nf + 1) = 1 + aMSs C (1),NS q,(2,L)(nf + 1) + aMSs 2[ A(2),NS,MSqq,Q (nf + 1) δ2 + C (2),NS q,(2,L)(nf + 1) ] . (5.19) Transformation to the MOM–scheme yields CNSq,(2,L)(nf ) + LNSq,(2,L)(nf + 1) = 1 + aMOMs C (1),NS q,(2,L)(nf + 1) + aMOMs 2 [ A(2),NS,MOMqq,Q (nf + 1) δ2 + β0,Q ln (m2 µ2 ) C(1),NSq,(2,L)(nf + 1) + C (2),NS q,(2,L)(nf + 1) ] . (5.20) 72 Note that A(2),NSqq,Q , Eq. (4.95), is not affected by this scheme transformation. As is obvious from Figure 7, the logarithmic term in Eq. (5.20) can therefore only be attributed to the massless Wilson coefficient. Separating the light from the heavy part one obtains L(2),NS,MOMq,(2,L) (nf + 1) = A(2),NS,MOMqq,Q (nf + 1) δ2 + β0,Q ln (m2 µ2 ) C(1),NSq,(2,L)(nf + 1) + Cˆ (2),NS q,(2,L)(nf ) . (5.21) This provides the same results as Eqs. (4.23)–(4.29) of Ref. [126]. These are the asymptotic expressions of the NS heavy flavor Wilson coefficients from Refs. [103], where only the case of QQ–production in the final state has been considered. Hence the logarithmic term in Eq. (5.21) just cancels the contributions due to diagrams (b), (c) in Figure 7. 73 6 Calculation of the Massive Operator Matrix Ele- ments up to O(a2sε) The quarkonic 2–loop massive OMEs A(2)Qg, A (2),PS Qq and A (2) qq,Q have been calculated for the first time in Ref. [126] to construct asymptotic expressions for the NLO heavy flavor Wil- son Coefficients in the limit Q2 ≫ m2, cf. Section 3.2. The corresponding gluonic OMEs A(2)gg,Q and A (2) gq,Q were calculated in Ref. [129], where they were used within a VFNS de- scription of heavy flavors in high–energy scattering processes, see Section 3.3. In these calculations, the integration–by–parts technique, [283], has been applied to reduce the number of propagators occurring in the momentum integrals. Subsequently, the integrals were calculated in z–space, which led to a variety of multiple integrals of logarithms, par- tially with complicated arguments. The final results were given in terms of polylogarithms and Nielsen–integrals, see Appendix C.4. The quarkonic terms have been confirmed in Ref. [128], cf. also [284], where a different approach was followed. The calculation was performed in Mellin–N space and by avoiding the integration–by–parts technique. Using representations in terms of generalized hypergeometric functions, the integrals could be expressed in terms of multiple finite and infinite sums with one free parameter, N . The advantage of this approach is that the evaluation of these sums can be automatized us- ing various techniques, simplifying the calculation. The final result is then obtained in Mellin–space in terms of nested harmonic sums or Z–sums, cf. [142, 143] and Appendix C.4. An additional simplification was found since the final result, e.g., for A(2)Qg can be expressed in terms of two basic harmonic sums only, using algebraic, [146], and structural relations, [147, 148], between them. This is another example of an observation which has been made for many different single scale quantities in high–energy physics, namely that the Mellin–space representation is better suited to the problem than the z–space representation. As has been outlined in Section 4, the O(ε)–terms of the unrenormalized 2–loop mas- sive OMEs are needed in the renormalization of the 3–loop contributions. In this Section, we calculate these terms based on the approach advocated in Ref. [128], which is a new result, [130, 137]. Additionally, we re–calculate the gluonic OMEs up to the constant term in ε for the first time, cf. [129,130]. Example diagrams for each OME are shown in Figure 8. In Section 6.1, we explain how the integrals are obtained in terms of finite and infinite sums using representations in terms of generalized hypergeometric functions, cf. [285,286] and Appendix C.2. For the calculation of these sums we mainly used the MATHEMATICA– based program Sigma, [153, 154], which is discussed in Section 6.2. The results are pre- sented in Section 6.3. Additionally, we make several remarks on the MOM–scheme, which has to be adopted intermediately for the renormalization of the coupling constant, cf. Section 4.4. In Section 6.4, different checks of the results are presented. 6.1 Representation in Terms of Hypergeometric Functions All diagrams contributing to the massive OMEs are shown in Figures 1–4 in Ref. [126] and in Figures 3,4 in Ref. [129], respectively. They represent 2–point functions with on–shell external momentum p, p2 = 0. They are expressed in two parameters, the heavy quark mass m and the Mellin–parameter N . Since the mass can be factored out of the integrals, the problem effectively contains a single scale. The parameter N represents the spin of 74 (Qg) (gq,Q) (gg,Q) (NS) (Qq, PS) Figure 8: Examples for 2–loop diagrams contributing to the massive OMEs. Thick lines: heavy quarks, curly lines: gluons, full lines: quarks. the composite operators, (2.86)–(2.88), and enters the calculation via the Feynman–rules for these objects, cf. Appendix B. Since the external momentum does not appear in the final result, the corresponding scalar integrals reduce to massive tadpoles if one sets N = 0. In order to explain our method, we consider first the massive 2–loop tadpole shown in Figure 9, from which all OMEs can be derived at this order, by attaching 2 outer legs and inserting the composite operator in all possible ways, i.e., both on the lines and on the vertices. ν3ν2ν1 Figure 9: Basic 2–loop massive tadpole In Figure 9, the wavy line is massless and the full lines are massive. Here νi labels the power of the propagator. We adopt the convention νi...j ≡ νi + ... + νj etc. The corresponding dimensionless momentum integral reads in Minkowski–space I1 = ∫ ∫ dDk1dDk2 (4π)4D (4π)4(−1)ν123−1(m2)ν123−D (k21 −m2)ν1(k21 − k22)ν2(k22 −m2)ν3 , (6.1) where we have attached a factor (4π)4(−1)ν123−1 for convenience. Using standard Feynman–parametrization and Eq. (4.3) for momentum integration, one obtains the fol- lowing Feynman–parameter integral I1 = Γ [ ν123 − 4− ε ν1, ν2, ν3 ]∫∫ 1 0 dxdy x 1+ε/2−ν2(1− x)ν23−3−ε/2yν3−1(1− y)ν12−3−ε/2 (4π)ε(1− xy)ν123−4−ε , (6.2) which belongs to the class of the hypergeometric function 3F2 with argument z = 1, see 75 Appendix C.2. Applying Eq. (C.19), one obtains I1 = S2ε exp ( ∞∑ i=2 ζi i ε i ) Γ [ ν123 − 4− ε, 2 + ε/2− ν2, ν23 − 2− ε/2, ν12 − 2− ε/2 1− ε, ν1, ν2, ν3, ν123 − 2− ε/2 ] × 3F2 [ ν123 − 4− ε, 2 + ε/2− ν2, ν3 ν3, ν123 − 2− ε/2 ; 1 ] , (6.3) where we have used Eq. (4.8). The term ν3 in the argument of the 3F2 cancels between nominator and denominator and thus one can use Gauss’s theorem, Eq. (C.16), to write the result in terms of Γ–functions I1 = Γ [ ν123 − 4− ε, 2 + ε/2− ν2, ν12 − 2− ε/2, ν23 − 2− ε/2 1− ε, 2 + ε/2, ν1, ν3, ν123 + ν2 − 4− ε ] S2ε exp ( ∞∑ i=2 ζi i ε i ) . (6.4) This calculation is of course trivial and Eq. (6.4) can be easily checked using MATAD, cf. Ref. [164] and Section 7.2. Next, let us consider the case of arbitrary moments in presence of the complete numerator structure. Since the final result contains the factor (∆.p)N , one cannot set p to zero anymore. This increases the number of propagators and hence the number of Feynman–parameters in Eq. (6.2). Additionally, the terms (∆.q)A in the integral lead to polynomials in the Feynman–parameters to a symbolic power in the integral, which can not be integrated trivially. Hence neither Eq. (C.19) nor Gauss’s theorem can be applied anymore in the general case. However, the structure of the integral in Eq. (6.2) does not change. For any diagram deriving from the 2–loop tadpole, a general integral of the type I2 = C2 ∫∫ 1 0 dxdy x a(1− x)byc(1− y)d (1− xy)e ∫ 1 0 dz1... ∫ 1 0 dzi P ( x, y, z1 . . . zi, N ) (6.5) is obtained. Here P is a rational function of x, y and possibly more parameters z1...zi. N denotes the Mellin–parameter and occurs in some exponents. Note that operator insertions with more than two legs give rise to additional finite sums in P, see Appendix B. For fixed values of N , one can expand P and the integral I2 turns into a finite sum over integrals of the type I1. The terms νi in these integrals might have been shifted by integers, but after expanding in ε, the one–fold infinite sum can be performed, e.g., using the FORM–based code Summer, [143]. To illustrate the sophistication occurring once one keeps the complete dependence on N in an example, we consider the scalar integral contributing to A(2)Qg shown in Figure 8. After momentum integration, it reads I3 = (∆p)N−2Γ(1− ε) (4π)4+ε(m2)1−ε ∫∫∫∫ dudzdydx(1− u) −ε/2z−ε/2(1− z)ε/2−1 (1− u+ uz)1−ε(x− y)[( zyu+ x(1− zu) )N−1 − ( (1− u)x+ uy )N−1 ] , (6.6) where we have performed the finite sum already, which stems from the operator insertion. Here and below, the Feynman-parameter integrals are carried out over the respective 76 unit-cube. This integral is of the type of Eq. (6.5) and the term x− y in the denominator cancels for fixed values of N . Due to the operator insertion on an internal vertex, it is one of the more involved integrals in the 2–loop case. For almost all other integrals, all but two parameters can be integrated automatically, leaving only a single infinite sum of the type of Eq. (6.3) with N appearing in the parameters of the hypergeometric function, cf. e.g. [128, 284, 287]. In order to render this example calculable, suitable variable transformations, as, e.g., given in Ref. [270], are applied, [128, 284]. Thus one arrives at the following double sum I3 = S2ε (∆p)N−2 (4π)4(m2)1−ε exp { ∞∑ l=2 ζl l ε l } 2π N sin(π2 ε) N∑ j=1 {(N j ) (−1)j + δj,N } × { Γ(j)Γ(j + 1− ε2) Γ(j + 2− ε)Γ(j + 1 + ε2) − B(1− ε 2 , 1 + j) j 3F2 [ 1− ε, ε2 , j + 1 1, j + 2− ε2 ; 1 ]} = S2ε (∆p)N−2 (4π)4(m2)1−ε { I(0)3 + I (1) 3 ε+O(ε2) } . (6.7) Note that in our approach no expansion in ε is needed until a sum–representation of the kind of Eq. (6.7) is obtained. Having performed the momentum integrations, the expressions of almost all diagrams were given in terms of single generalized hypergeometric series 3F2 at z = 1, with possibly additional finite summations. These infinite sums could then be safely expanded in ε, leading to different kinds of sums depending on the Mellin– parameter N . The summands are typically products of harmonic sums with different arguments, weighted by summation parameters and contain hypergeometric terms 21, like binomials or Beta–function factors B(N, i), cf. Eq. (C.9). Here i is a summation– index. In the most difficult cases, double sums as in Eq. (6.7) or even triple sums were obtained, which had to be treated accordingly. In general, these sums can be expressed in terms of nested harmonic sums and ζ–values. Note that sums containing Beta–functions with different arguments, e.g. B(i, i), B(N + i, i), usually do not lead to harmonic sums in the final result. Some of these sums can be performed by the existing packages [143, 149, 150]. However, there exists so far no automatic computer program to calculate sums which contain Beta–function factors of the type B(N, i) and single harmonic sums in the summand. These sums can be calculated applying analytic methods, as integral representations, and general summation methods, as encoded in the Sigma package [151– 154]. In the next Section, we will present details on this. Before finishing this Section, we give the result in terms of harmonic sums for the double sum in Eq. (6.7) applying these summation methods. The O(ε0) of Eq. (6.7) is needed for the constant term a(2)Qg, cf. Refs. [128,287]. The linear term in ε reads I(1)3 = 1 N [ −2S2,1 + 2S3 + 4N + 1 N S2 − S21 N − 4 NS1 ] , (6.8) where we adopt the notation to take harmonic sums at argument N , if not stated other- wise. 21f(k) is hypergeometric in k iff f(k + 1)/f(k) = g(k) for some fixed rational function g(k). 77 6.2 Difference Equations and Infinite Summation Single scale quantities in renormalizable quantum field theories are most simply repre- sented in terms of nested harmonic sums, cf. [142, 143] and Appendix C.4, which holds at least up to 3–loop order for massless Yang–Mills theories and for a wide class of different processes. This includes the anomalous dimensions and massless Wilson co- efficients for unpolarized and polarized space- and time-like processes to 3–loop order, the Wilson coefficients for the Drell-Yan process and pseudoscalar and scalar Higgs– boson production in hadron scattering in the heavy quark mass limit, as well as the soft- and virtual corrections to Bhabha scattering in the on–mass–shell–scheme to 2–loop order, cf. [95, 115, 124, 125, 138, 144, 145]. The corresponding Feynman–parameter inte- grals are such that nested harmonic sums appear in a natural way, working in Mellin space, [147, 148]. Single scale massive quantities at 2 loops, like the unpolarized and polarized heavy-flavor Wilson coefficients in the region Q2 ≫ m2 as considered in this thesis, belong also to this class, [126–128, 157, 160, 165, 287–289]. Finite harmonic sums obey algebraic, cf. [146], and structural relations, [147], which can be used to obtain simplified expressions and both shorten the calculations and yield compact final results. These representations have to be mapped to momentum-fraction space to use the respec- tive quantities in experimental analyzes. This is obtained by an Mellin inverse transform which requires the analytic continuation of the harmonic sums w.r.t. the Mellin index N ∈ C, [147,148,210]. Calculating the massive OMEs in Mellin space, new types of infinite sums occur if compared to massless calculations. In the latter case, summation algorithms as Sum- mer, [143], Nestedsums, [149], and Xsummer, [150], may be used to calculate the respec- tive sums. Summer and Xsummer are based on FORM, while Nestedsums is based on GiNaC, [290]. The new sums which emerge in [128,137,157,287–289] can be calculated in different ways. In Ref. [128, 157], we chose analytic methods and in the former reference all sums are given which are needed to calculate the constant term of the massive OMEs. Few of these sums can be calculated using general theorems, as Gauss’ theorem, (C.16), Dixon’s theorem, [285], or summation tables in the literature, cf. [143,291]. In order to calculate the gluonic OMEs as well as the O(ε)–terms, many new sums had to be evaluated. For this we adopted a more systematic technique based on difference equations, which are the discrete equivalent of differential equations, cf. [292]. This is a promising approach, since it allowed us to obtain all sums needed automatically and it may be applied to entirely different single–scale processes as well. It is based on applying general summation algorithms in computer algebra. A first method is Gosper’s telescoping algorithm, [293], for hypergeometric terms. For practical applications, Zeilberger’s exten- sion of Gosper’s algorithm to creative telescoping, [294, 295], can be considered as the breakthrough in symbolic summation. The recent summation package Sigma, [151–154], written in MATHEMATICA opens up completely new possibilities in symbolic summation. Based on Karr’s ΠΣ-difference fields, [296], and further refinements, [151,297], the pack- age contains summation algorithms, [298], that allow to solve not only hypergeometric sums, like Gosper’s and Zeilberger’s algorithms, but also sums involving indefinite nested sums. In this algebraic setting, one can represent completely algorithmically indefinite nested sums and products without introducing any algebraic relations between them. Note that this general class of expressions covers as special cases the harmonic sums or generalized nested harmonic sums, cf. [155, 299–301]. Given such an optimal representa- tion, by introducing as less sums as possible, various summation principles are available 78 in Sigma. In this work, we applied the following strategy which has been generalized from the hypergeometric case, [295,302], to the ΠΣ-field setting. 1. Given a definite sum that involves an extra parameter N , we compute a recurrence relation in N that is fulfilled by the input sum. The underlying difference field algorithms exploit Zeilberger’s creative telescoping principle, [295,302]. 2. Then we solve the derived recurrence in terms of the so-called d’Alembertian solu- tions, [295, 302]. Since this class covers the harmonic sums, we find all solutions in terms of harmonic sums. 3. Taking the initial values of the original input sum, we can combine the solutions found from step 2 in order to arrive at a closed representation in terms of harmonic sums. In the following, we give some examples on how Sigma works. A few typical sums we had to calculate are listed in Appendix D and a complete set of sums needed to calculate the 2–Loop OMEs up to O(ε) can be found in Appendix B of Refs. [128, 137]. Note that in this calculation also more well-known sums are occurring which can, e.g., be easily solved using Summer. 6.2.1 The Sigma-Approach As a first example we consider the sum T1(N) ≡ ∞∑ i=1 B(N, i) i+N + 2S1(i)S1(N + i) . (6.9) We treat the upper bound of the sum as a finite integer, i.e., we consider the truncated version T1(a,N) ≡ a∑ i=1 B(N, i) i+N + 2S1(i)S1(N + i), for a ∈ N. Given this sum as input, we apply Sigma’s creative telescoping algorithm and find a recurrence for T1(a,N) of the form c0(N)T (a,N) + . . . cd(N)T (a,N + d) = q(a,N) (6.10) with order d = 4. Here, the ci(N) and q(a,N) are known functions of N and a. Finally, we perform the limit a→∞ and we end up at the recurrence −N(N + 1)(N + 2)2 { 4N5 + 68N4 + 455N3 + 1494N2 + 2402N + 1510 } T1(N) − (N + 1)(N + 2)(N + 3) { 16N5 + 260N4 + 1660N3 + 5188N2 + 7912N + 4699 } × T1(N + 1) + (N + 2)(N + 4)(2N + 5) { 4N6 + 74N5 + 542N4 + 1978N3 + 3680N2 + 3103N + 767 } T1(N + 2) + (N + 4)(N + 5) { 16N6 + 276N5 + 1928N4 + 6968N3 + 13716N2 + 13929N + 5707 } T1(N + 3)− (N + 4)(N + 5)2(N + 6) { 4N5 + 48N4 + 223N3 + 497N2 + 527N + 211 } T1(N + 4) = P1(N) + P2(N)S1(N) 79 where P1(N) = ( 32N18 + 1232N17 + 21512N16 + 223472N15 + 1514464N14 + 6806114N13 + 18666770N12 + 15297623N11 − 116877645N10 − 641458913N9 − 1826931522N8 − 3507205291N7 − 4825457477N6 − 4839106893N5 − 3535231014N4 − 1860247616N3 − 684064448N2 − 160164480N − 17395200 ) /( N3(N + 1)3(N + 2)3(N + 3)2(N + 4)(N + 5) ) and P2(N) = −4 ( (4N14 + 150N13 + 2610N12 + 27717N11 + 199197N10 + 1017704N9 + 3786588N8 + 10355813N7 + 20779613N6 + 30225025N5 + 31132328N4 + 21872237N3 + 9912442N2 + 2672360N + 362400 ) /( N2(N + 1)2(N + 2)2(N + 3)(N + 4)(N + 5) ) . In the next step, we apply Sigma’s recurrence solver to the computed recurrence and find the four linearly independent solutions h1(N) = 1 N + 2 , h2(N) = (−1)N N(N + 1)(N + 2) , h3(N) = S1(N) N + 2 , h4(N) = (−1) N ( 1 + (N + 1)S1(N) ) N(N + 1)2(N + 2) , of the homogeneous version of the recurrence and the particular solution p(N) = 2(−1) N N(N + 1)(N + 2) [ 2S−2,1(N)− 3S−3(N)− 2S−2(N)S1(N)− ζ2S1(N) −ζ3 − 2S−2(N) + ζ2 N + 1 ] − 2S3(N)− ζ3N + 2 − S2(N)− ζ2 N + 2 S1(N) + 2 + 7N + 7N2 + 5N3 +N4 N3(N + 1)3(N + 2) S1(N) + 2 2 + 7N + 9N2 + 4N3 +N4 N4(N + 1)3(N + 2) of the recurrence itself. Finally, we look for constants c1, . . . , c4 such that T1(N) = c1 h1(N) + c2 h2(N) + c3 h3(N) + c4 h4(N) + p(N) . The calculation of the necessary initial values for N = 0, 1, 2, 3 does not pose a problem for Sigma and we conclude that c1 = c2 = c3 = c4 = 0. Hence the final result reads T1(N) = 2(−1)N N(N + 1)(N + 2) [ 2S−2,1(N)− 3S−3(N)− 2S−2(N)S1(N)− ζ2S1(N) −ζ3 − 2S−2(N) + ζ2 N + 1 ] − 2S3(N)− ζ3N + 2 − S2(N)− ζ2 N + 2 S1(N) + 2 + 7N + 7N2 + 5N3 +N4 N3(N + 1)3(N + 2) S1(N) + 2 2 + 7N + 9N2 + 4N3 +N4 N4(N + 1)3(N + 2) . (6.11) 80 Using more refined algorithms of Sigma, see e.g. [303], even a first order difference equation can be obtained (N + 2)T1(N)− (N + 3)T1(N + 1) = 2 (−1)N N(N + 2) ( − 3N + 4 (N + 1)(N + 2) ( ζ2 + 2S−2(N) ) − 2ζ3 − 2S−3(N)− 2ζ2S1(N) −4S1,−2(N) ) + N6 + 8N5 + 31N4 + 66N3 + 88N2 + 64N + 16 N3(N + 1)2(N + 2)3 S1(N) + S2(N)− ζ2 N + 1 + 2 N5 + 5N4 + 21N3 + 38N2 + 28N + 8 N4(N + 1)2(N + 2)2 . (6.12) However, in deriving Eq. (6.12), use had to be made of further sums of less complexity, which had to be calculated separately. As above, we can easily solve the recurrence and obtain again the result (6.11). Here and in the following we applied various algebraic relations between harmonic sums to obtain a simplification of our results, cf. [146]. 6.2.2 Alternative Approaches As a second example we consider the sum T2(N) ≡ ∞∑ i=1 S21(i+N) i2 , (6.13) which does not contain a Beta–function. In a first attempt, we proceed as in the first example T1(N). The naive application of Sigma yields a fifth order difference equation, which is clearly too complex for this sum. However, similar to the situation T1(N), Sigma can reduce it to a third order relation which reads T2(N)(N + 1)2 − T2(N + 1)(3N2 + 10N + 9) +T2(N + 2)(3N2 + 14N + 17)− T2(N + 3)(N + 3)2 = 6N5 + 48N4 + 143N3 + 186N2 + 81N − 12 (N + 1)2(N + 2)3(N + 3)2 − 2 2N2 + 7N + 7 (N + 1)(N + 2)2(N + 3)S1(N) + −2N6 − 24N5 − 116N4 − 288N3 − 386N2 − 264N − 72 (N + 1)2(N + 2)3(N + 3)2 ζ2 . (6.14) Solving this recurrence relation in terms of harmonic sums gives a closed form, see (6.20) below. Still (6.14) represents a rather involved way to solve the problem. It is of advantage to map the numerator S21(i+N) into a linear representation, which can be achieved using Euler’s relation S2a(N) = 2Sa,a(N)− S2a(N), a > 0 . (6.15) This is realized in Summer by the basis–command for general–type harmonic sums, T2(N) = ∞∑ i=1 2S1,1(i+N)− S2(i+N) i2 . (6.16) 81 As outlined in Ref. [143], sums of this type can be evaluated by considering the difference D2(j) = T2(j)− T2(j − 1) = 2 ∞∑ i=1 S1(j + i) i − ∞∑ i=1 1 i2(j + i)2 . (6.17) The solution is then obtained by summing (6.17) to T2(N) = N∑ j=1 D2(j) + T2(0) . (6.18) The sums in Eq. (6.17) are now calculable trivially or are of less complexity than the original sum. In the case considered here, only the first sum on the left hand side is not trivial. However, after partial fractioning, one can repeat the same procedure, resulting into another difference equation, which is now easily solved. Thus using this technique, the solution of Eq. (6.13) can be obtained by summing two first order difference equations or solving a second order one. The above procedure is well known and some of the summation–algorithms of Summer are based on it. As a consequence, infinite sums with an arbitrary number of harmonic sums with the same argument can be performed using this package. Note that sums containing harmonic sums with different arguments, see e.g Eq. (6.21), can in principle be summed automatically using the same approach. However, this feature is not yet built into Summer. A third way to obtain the sum (6.13) consists of using integral representations for harmonic sums, [142]. One finds T2(N) = 2 ∞∑ i=1 ∫ 1 0 dxx i+N i2 ( ln(1− x) 1− x ) + − ∞∑ i=1 (∫ 1 0 dxx i+N i2 ln(x) 1− x + ζ2 i2 ) = 2M [( ln(1− x) 1− x ) + Li2(x) ] (N + 1) − ( M [ ln(x) 1− xLi2(x) ] (N + 1) + ζ22 ) . (6.19) Here the Mellin–transform is defined in Eq. (2.65). Eq. (6.19) can then be easily calculated since the corresponding Mellin–transforms are well–known, [142]. Either of these three methods above lead to T2(N) = 17 10 ζ22 + 4S1(N)ζ3 + S21(N)ζ2 − S2(N)ζ2 − 2S1(N)S2,1(N)− S2,2(N) . (6.20) As a third example we would like to evaluate the sum T3(N) = ∞∑ i=1 S21(i+N)S1(i) i . (6.21) Note that (6.21) is divergent. In order to treat this divergence, the symbol σ1, cf. Eq. (C.35), is used. The application of Sigma to this sum yields a fourth order difference equation (N + 1)2(N + 2)T2(N)− (N + 2) ( 4N2 + 15N + 15 ) T2(N + 1) +(2N + 5) ( 3N2 + 15N + 20 ) T2(N + 2)− (N + 3) ( 4N2 + 25N + 40 ) T2(N + 3) +(N + 3)(N + 4)2T2(N + 4) = 6N5 + 73N4 + 329N3 + 684N2 + 645N + 215 (N + 1)2(N + 2)2(N + 3)2 + 6N2 + 19N + 9 (N + 1)(N + 2)(N + 3)S1(N) , (6.22) 82 which can be solved. As in the foregoing example the better way to calculate the sum is to first change S21(i+N) into a linear basis representation T3(N) = ∞∑ i=1 2S1,1(i+N)− S2(i+N) i S1(i) . (6.23) One may now calculate T3(N) using telescoping for the difference D3(j) = T3(j)− T3(j − 1) = 2 ∞∑ i=1 S1(i+ j)S1(i) i(i+ j) − ∞∑ i=1 S1(i) i(i+ j)2 , (6.24) with T3(N) = N∑ j=1 D2(j) + T3(0) . (6.25) One finally obtains T3(N) = σ41 4 + 43 20 ζ22 + 5S1(N)ζ3 + 3S21(N)− S2(N) 2 ζ2 − 2S1(N)S2,1(N) +S21(N)S2(N) + S1(N)S3(N)− S22(N) 4 + S41(N) 4 . (6.26) 6.3 Results For the singlet contributions, we leave out an overall factor 1 + (−1)N 2 (6.27) in the following. This factor emerges naturally in our calculation and is due to the fact that in the light–cone expansion, only even values of N contribute to F2 and FL, cf. Section 2.3. Additionally, we do not choose a linear representation in terms of harmonic sums as was done in Refs. [115,124,125], since these are non–minimal w.r.t. to the corresponding quasi– shuffle algebra, [304]. Due to this a much smaller number of harmonic sums contributes. Remainder terms can be expressed in polynomials Pi(N). Single harmonic sums with negative index are expressed in terms of the function β(N + 1), cf. Appendix C.4. For completeness, we also give all pole terms and the constant terms of the quarkonic OMEs. The latter have been obtained before in Refs. [126,128]. The pole terms can be expressed via the LO–, [46], and the fermionic parts of the NLO, [119–123], anomalous dimensions and the 1–loop β–function, [39–41,275]. We first consider the matrix element A(2)Qg, which is the most complex of the 2–loop OMEs. For the calculation we used the projector given in Eq. (4.22) and therefore have to include diagrams with external ghost lines as well. The 1–loop result is straightforward to calculate and has already been given in Eqs. (4.111, 4.113). As explained in Section 4, we perform the calculation accounting for 1–particle reducible diagrams. Hence the 1– loop massive gluon self–energy term, Eq. (4.84), contributes. The unrenormalized 2–loop OME is then given in terms of 1–particle irreducible and reducible contributions by ˆˆA (2) Qg = ˆˆA (2),irr Qg − ˆˆA (1) QgΠˆ (1) ( 0, mˆ 2 µ2 ) . (6.28) 83 Using the techniques described in the previous Sections, the pole–terms predicted by renormalization in Eq. (4.112) are obtained, which have been given in Refs. [126, 128] before. Here, the contributing 1–loop anomalous dimensions are γ(0)qq = 4CF { 2S1 − 3N2 + 3N + 2 2N(N + 1) } , (6.29) γˆ(0)qg = −8TF N2 +N + 2 N(N + 1)(N + 2) , (6.30) γ(0)gg = 8CA { S1 − 2(N2 +N + 1) (N − 1)N(N + 1)(N + 2) } − 2β0 , (6.31) and the 2–loop contribution reads γˆ(1)qg = 8CFTF { 2 N2 +N + 2 N(N + 1)(N + 2) [ S2 − S21 ] + 4 N2S1 − P1 N3(N + 1)3(N + 2) } +16CATF { N2 +N + 2 N(N + 1)(N + 2) [ S2 + S21 − 2β′ − ζ2 ] − 4(2N + 3)S1 (N + 1)2(N + 2)2 − P2 (N − 1)N3(N + 1)3(N + 2)3 } , (6.32) P1 = 5N6 + 15N5 + 36N4 + 51N3 + 25N2 + 8N + 4 , P2 = N9 + 6N8 + 15N7 + 25N6 + 36N5 + 85N4 + 128N3 +104N2 + 64N + 16 . (6.33) These terms agree with the literature and provide a strong check on the calculation. The constant term in ε in Eq. (4.112) is determined after mass renormalization, [126,128,284]. a(2)Qg = TFCF { 4(N2 +N + 2) 3N(N + 1)(N + 2) ( 4S3 − 3S2S1 − S31 − 6S1ζ2 ) + 4 3N + 2 N2(N + 2)S 2 1 +4 N4 + 17N3 + 17N2 − 5N − 2 N2(N + 1)2(N + 2) S2 + 2 (3N2 + 3N + 2)(N2 +N + 2) N2(N + 1)2(N + 2) ζ2 +4 N4 −N3 − 20N2 − 10N − 4 N2(N + 1)2(N + 2) S1 + 2P3 N4(N + 1)4(N + 2) } +TFCA { 2(N2 +N + 2) 3N(N + 1)(N + 2) ( −24S−2,1 + 6β′′ + 16S3 − 24β′S1 + 18S2S1 + 2S31 −9ζ3 ) − 16 N 2 −N − 4 (N + 1)2(N + 2)2β ′ − 47N 5 + 21N4 + 13N3 + 21N2 + 18N + 16 (N − 1)N2(N + 1)2(N + 2)2 S2 −4N 3 + 8N2 + 11N + 2 N(N + 1)2(N + 2)2 S 2 1 − 8 N4 − 2N3 + 5N2 + 2N + 2 (N − 1)N2(N + 1)2(N + 2)ζ2 − 4P4N(N + 1)3(N + 2)3S1 + 4P5 (N − 1)N4(N + 1)4(N + 2)4 } , (6.34) 84 where the polynomials in Eq. (6.34) are given by P3 = 12N8 + 52N7 + 132N6 + 216N5 + 191N4 + 54N3 − 25N2 −20N − 4 , (6.35) P4 = N6 + 8N5 + 23N4 + 54N3 + 94N2 + 72N + 8 , (6.36) P5 = 2N12 + 20N11 + 86N10 + 192N9 + 199N8 −N7 − 297N6 − 495N5 −514N4 − 488N3 − 416N2 − 176N − 32 . (6.37) The newly calculated O(ε) contribution to A(2)Qg, [137], reads after mass renormalization a(2)Qg = TFCF { N2 +N + 2 N(N + 1)(N + 2) ( 16S2,1,1 − 8S3,1 − 8S2,1S1 + 3S4 − 4 3 S3S1 − 1 2 S22 −S2S21 − 1 6 S41 + 2ζ2S2 − 2ζ2S21 − 8 3 ζ3S1 ) − 8 N 2 − 3N − 2 N2(N + 1)(N + 2)S2,1 + 2 3 3N + 2 N2(N + 2)S 3 1 + 2 3 3N4 + 48N3 + 43N2 − 22N − 8 N2(N + 1)2(N + 2) S3 + 2 3N + 2 N2(N + 2)S2S1 +4 S1 N2 ζ2 + 2 3 (N2 +N + 2)(3N2 + 3N + 2) N2(N + 1)2(N + 2) ζ3 + P6 N3(N + 1)3(N + 2)S2 + N4 − 5N3 − 32N2 − 18N − 4 N2(N + 1)2(N + 2) S 2 1 − 2 2N5 − 2N4 − 11N3 − 19N2 − 44N − 12 N2(N + 1)3(N + 2) S1 −5N 6 + 15N5 + 36N4 + 51N3 + 25N2 + 8N + 4 N3(N + 1)3(N + 2) ζ2 − P7 N5(N + 1)5(N + 2) } +TFCA { N2 +N + 2 N(N + 1)(N + 2) ( 16S−2,1,1 − 4S2,1,1 − 8S−3,1 − 8S−2,2 − 4S3,1 − 2 3 β′′′ +9S4 − 16S−2,1S1 + 40 3 S1S3 + 4β′′S1 − 8β′S2 + 1 2 S22 − 8β′S21 + 5S21S2 + 1 6 S41 −10 3 S1ζ3 − 2S2ζ2 − 2S21ζ2 − 4β′ζ2 − 17 5 ζ22 ) − 8 N 2 +N − 1 (N + 1)2(N + 2)2 ζ2S1 + 4(N2 −N − 4) (N + 1)2(N + 2)2 ( −4S−2,1 + β′′ − 4β′S1 ) − 2 3 N3 + 8N2 + 11N + 2 N(N + 1)2(N + 2)2 S 3 1 −16 3 N5 + 10N4 + 9N3 + 3N2 + 7N + 6 (N − 1)N2(N + 1)2(N + 2)2 S3 + 8 N4 + 2N3 + 7N2 + 22N + 20 (N + 1)3(N + 2)3 β ′ +2 3N3 − 12N2 − 27N − 2 N(N + 1)2(N + 2)2 S2S1 − 2 3 9N5 − 10N4 − 11N3 + 68N2 + 24N + 16 (N − 1)N2(N + 1)2(N + 2)2 ζ3 − P8S2 (N − 1)N3(N + 1)3(N + 2)3 − P10S21 N(N + 1)3(N + 2)3 + 2P11S1 N(N + 1)4(N + 2)4 − 2P9ζ2 (N − 1)N3(N + 1)3(N + 2)2 − 2P12 (N − 1)N5(N + 1)5(N + 2)5 } , (6.38) with the polynomials P6 = 3N6 + 30N5 + 15N4 − 64N3 − 56N2 − 20N − 8 , (6.39) 85 P7 = 24N10 + 136N9 + 395N8 + 704N7 + 739N6 + 407N5 + 87N4 +27N3 + 45N2 + 24N + 4 , (6.40) P8 = N9 + 21N8 + 85N7 + 105N6 + 42N5 + 290N4 + 600N3 + 456N2 +256N + 64 , (6.41) P9 = (N3 + 3N2 + 12N + 4)(N5 −N4 + 5N2 +N + 2) , (6.42) P10 = N6 + 6N5 + 7N4 + 4N3 + 18N2 + 16N − 8 , (6.43) P11 = 2N8 + 22N7 + 117N6 + 386N5 + 759N4 + 810N3 + 396N2 +72N + 32 , (6.44) P12 = 4N15 + 50N14 + 267N13 + 765N12 + 1183N11 + 682N10 − 826N9 −1858N8 − 1116N7 + 457N6 + 1500N5 + 2268N4 + 2400N3 +1392N2 + 448N + 64 . (6.45) Note that the terms ∝ ζ3 in Eq. (6.34) and ∝ ζ22 in Eq. (6.38) are only due to the representation using the β(k)–functions and are absent in representations using harmonic sums. The results for the individual diagrams contributing to A(2)Qg can be found up to O(ε0) in Ref. [128] and at O(ε) in Ref. [137]. Since harmonic sums appear in a wide variety of applications, it is interesting to study the pattern in which they emerge. In Table 1, we list the harmonic sums contributing to each individual diagram 22. The β–function and their derivatives can be traced back to Table 1: Complexity of the results for the individual diagrams contributing to A(2)Qg Diagram S1 S2 S3 S4 S−2 S−3 S−4 S2,1 S−2,1 S−2,2 S3,1 S−3,1 S2,1,1 S−2,1,1 A + + B + + + + + + + C + + D + + + + E + + + + F + + + + + + G + + + + H + + + + I + + + + + + + + + + + + + + J + + K + + L + + + + + + + M + + N + + + + + + + + + + + + + + O + + + + + + + P + + + + + + + S + + T + + the single non–alternating harmonic sums, allowing for half-integer arguments, cf. [142] and Appendix C.4. Therefore, all single harmonic sums form an equivalence class being represented by the sum S1, from which the other single harmonic sums are easily derived through differentiation and half-integer relations Additionally, we have already made use of the algebraic relations, [146], between harmonic sums in deriving Eqs. (6.34, 6.38). Moreover, the sums S−2,2 and S3,1 obey structural relations to other harmonic sums, i.e., they lie in corresponding equivalence classes and may be obtained by either rational argument relations and/or differentiation w.r.t. N . Reference to these equivalence classes is useful since the representation of these sums for N ǫ C needs not to be derived newly, 22Cf. Ref. [126] for the labeling of the diagrams. 86 except of straightforward differentiations. All functions involved are meromorphic, with poles at the non–negative integers. Thus the O(ε0)–term depends on two basic functions only, S1 and S−2,1 23. This has to be compared to the z–space representation used in Ref. [126], in which 48 different functions were needed. As shown in [142], various of these functions have Mellin transforms containing triple sums, which do not occur in our approach even on the level of individual diagrams. Thus the method applied here allowed to compactify the representation of the heavy flavor matrix elements and Wilson coefficients significantly. The O(ε)–term consists of 6 basic functions only, which are given by {S1, S2, S3, S4, S−2, S−3, S−4}, S2,1, S−2,1, S−3,1, S2,1,1, S−2,1,1 , (6.46) S−2,2 : depends on S−2,1, S−3,1 S3,1 : depends on S2,1 . The absence of harmonic sums containing {−1} as index was noted before for all other classes of space– and time–like anomalous dimensions and Wilson coefficients, including those for other hard processes having been calculated so far, cf. [95,144,145]. This can not be seen if one applies the z–space representation or the linear representation in Mellin– space, [109]. Analytic continuation, e.g., for S−2,1 proceeds via the equality, M [ Li2(x) 1 + x ] (N + 1)− ζ2β(N + 1) = (−1)N+1 [ S−2,1(N) + 5 8 ζ3 ] (6.47) with similar representations for the remaining sums, [142] 24. As discussed in [127], the result for a(2)Qg agrees with that in z–space given in Ref. [126]. However, there is a difference concerning the complete renormalized expression for A(2)Qg. This is due to the scheme–dependence for the renormalization of the coupling constant, which has been described in Sections 4.4, 5.1 and emerges for the first time at O(a2s). Comparing Eq. (4.114) for the renormalized result in the MS–scheme for the coupling constant with the transformation formula to the MOM–scheme, Eq. (5.12), this difference is given by A(2),MSQg = A (2),MOM Qg − β0,Q γˆ(0)qg 2 ln2 (m2 µ2 ) . (6.48) As an example, the second moment of the massive OME up to 2–loops reads in the MS–scheme for coupling constant renormalization AMSQg = aMSs { −4 3 TF ln (m2 µ2 )} + aMSs 2 { TF [22 9 CA − 16 9 CF − 16 9 TF ] ln2 (m2 µ2 ) + TF [ −70 27 CA − 148 27 CF ] ln (m2 µ2 ) − 7 9 CATF + 1352 81 CFTF } , (6.49) 23The associated Mellin transform to this sum has been discussed in Ref. [121] first. 24Note that the argument of the Mellin-transform in Eq. (36), Ref. [127], should read (N + 1). 87 and in the MOM–scheme AMOMQg = aMOMs { −4 3 TF ln (m2 µ2 )} + aMOMs 2 { TF [22 9 CA − 16 9 CF ] ln2 (m2 µ2 ) + TF [ −70 27 CA − 148 27 CF ] ln (m2 µ2 ) − 7 9 CATF + 1352 81 CFTF } . (6.50) As one infers from the above formulas, this difference affects at the 2–loop level only the double logarithmic term and stems from the treatment of the 1–particle–reducible contributions. In Ref. [126], these contributions were absorbed into the coupling constant, applying the MOM–scheme. This was motivated by the need to eliminate the virtual contributions due to heavier quarks (b, t) and was also extended to the charm–quark, thus adopting the same renormalization scheme as has been used in Refs. [103] for the exact calculation of the heavy flavor contributions to the Wilson coefficients. Contrary, in Ref. [129], the MS–description was applied and the strong coupling constant depends on nf + 1 flavors, cf. the discussion in Section 5.1. The remaining massive OMEs are less complex than the term A(2)Qg and depend only on single harmonic sums, i.e. on only one basic function, S1. In the PS–case, the LO and NLO anomalous dimensions γ(0)gq = −4CF N2 +N + 2 (N − 1)N(N + 1) , (6.51) γˆ(1),PSqq = −16CFTF 5N5 + 32N4 + 49N3 + 38N2 + 28N + 8 (N − 1)N3(N + 1)3(N + 2)2 (6.52) contribute. The pole–terms are given by Eq. (4.100) and we obtain for the higher order terms in ε a(2),PSQq = CFTF { − 4(N 2 +N + 2)2 (2S2 + ζ2) (N − 1)N2(N + 1)2(N + 2) + 4P13 (N − 1)N4(N + 1)4(N + 2)3 } , (6.53) P13 = N10 + 8N9 + 29N8 + 49N7 − 11N6 − 131N5 − 161N4 −160N3 − 168N2 − 80N − 16 , (6.54) a(2),PSQq = CFTF { −2(5N 3 + 7N2 + 4N + 4)(N2 + 5N + 2) (N − 1)N3(N + 1)3(N + 2)2 (2S2 + ζ2) − 4(N 2 +N + 2)2 (3S3 + ζ3) 3(N − 1)N2(N + 1)2(N + 2) + 2P14 (N − 1)N5(N + 1)5(N + 2)4 } , (6.55) P14 = 5N11 + 62N10 + 252N9 + 374N8 − 400N6 + 38N7 − 473N5 −682N4 − 904N3 − 592N2 − 208N − 32 . (6.56) Since the PS–OME emerges for the first time at O(a2s), there is no difference between its representation in the MOM– and the MS–scheme. The renormalized OME A(2)PSQq is given 88 in Eq. (4.101) and the second moment reads APS,MSQq = aMSs 2 { −16 9 ln2 (m2 µ2 ) − 80 27 ln (m2 µ2 ) − 4 } CFTF +O(aMSs 3 ) . (6.57) The flavor non-singlet NLO anomalous dimension is given by γˆ(1),NSqq = 4CFTF 3 { 8S2 − 40 3 S1 + 3N4 + 6N3 + 47N2 + 20N − 12 3N2(N + 1)2 } . (6.58) The unrenormalized OME is obtained from the 1–particle irreducible graphs and the contributions of heavy quark loops to the quark self–energy. The latter is given at O(aˆ2s) in Eq. (4.87). One obtains ˆˆA (2),NS qq,Q = ˆˆA (2),NS,irred qq,Q − Σˆ(2)(0, mˆ2 µ2 ) . (6.59) Our result is of the structure given in Eq. (4.93) and the higher order terms in ε read a(2),NSqq,Q = CFTF 3 { −8S3 − 8ζ2S1 + 40 3 S2 + 2 3N2 + 3N + 2 N(N + 1) ζ2 − 224 9 S1 + 219N6 + 657N5 + 1193N4 + 763N3 − 40N2 − 48N + 72 18N3(N + 1)3 } , (6.60) a(2),NSqq,Q = CFTF 3 { 4S4 + 4S2ζ2 − 8 3 S1ζ3 + 112 9 S2 + 3N4 + 6N3 + 47N2 + 20N − 12 6N2(N + 1)2 ζ2 −20 3 S1ζ2 − 20 3 S3 − 656 27 S1 + 2 3N2 + 3N + 2 3N(N + 1) ζ3 + P15 216N4(N + 1)4 } , (6.61) P15 = 1551N8 + 6204N7 + 15338N6 + 17868N5 + 8319N4 +944N3 + 528N2 − 144N − 432 . (6.62) The anomalous dimensions in Eqs. (6.51, 6.52, 6.58) agree with the literature. Eqs. (6.53, 6.60), cf. Ref. [128], were first given in Ref. [126] and agree with the re- sults presented there. Eqs. (6.55, 6.61), [137], are new results of this thesis. As in the PS case, the NS OME emerges for the first time at O(a2s). The corresponding renormalized OME A(2),NSqq,Q is given in Eq. (4.95) and the second moment reads ANS,MSqq,Q = aMSs 2 { −16 9 ln2 (m2 µ2 ) − 128 27 ln (m2 µ2 ) − 128 27 } CFTF +O(aMSs 3 ) . (6.63) Note that the first moment of the NS–OME vanishes, even on the unrenormalized level up to O(ε). This provides a check on the results in Eqs. (6.60, 6.61), because this is required by fermion number conservation. At this point an additional comment on the difference between the MOM and the MS–scheme is in order. The MOM–scheme was applied in Ref. [126] for two different 89 purposes. The first one is described below Eq. (6.50). It was introduced to absorb the contributions of one–particle reducible diagrams and heavier quarks into the definition of the coupling constant. However, in case of A(2)Qg, renormalization in the MOM–scheme and the scheme transformation from the MOM–scheme to the MS–scheme accidentally commute. This means, that one could apply Eq. (4.110) in the MS–scheme, i.e., set δaMOMs,1 = δaMSs,1 (nf + 1) (6.64) from the start and obtain Eq. (4.114) for the renormalized result. This is not the case for A(2),NSqq,Q . As mentioned earlier, the scheme transformation does not have an effect on this term at 2–loop order. This means that Eq. (4.91) should yield the same renormalized result in the MOM– and in the MS–scheme. However, in the latter case, the difference of Z–factors does not contain the mass. Thus a term ∝ 1ε ln (m2 µ2 ) , (6.65) which stems from the expansion of the unrenormalized result in Eq. (4.93), can not be subtracted. The reason for this is the following. As pointed out in Ref. [126], the term Aˆ(2),NSqq,Q is only UV–divergent. However, this is only the case if one imposes the condition that the heavy quark contributions to the gluon self–energy vanishes for on–shell momen- tum of the gluon. This is exactly the condition we imposed for renormalization in the MOM–scheme, cf. Section 4.4. Hence in this case, the additional divergences absorbed into the coupling are of the collinear type, contrary to the term in A(2)Qg. By applying the transformation back to the MS–scheme, we treat these two different terms in a concise way. This is especially important at the three–loop level, since in this case both effects are observed for all OMEs and the renormalization would not be possible if not applying the MOM–scheme first. Let us now turn to the gluonic OMEs A(2)gg,Q, A (2) gq,Q, which are not needed for the asymptotic 2–loop heavy flavor Wilson coefficients. They contribute, however, in the VFNS–description of heavy flavor parton densities, cf. Ref. [129] and Section 3.3. The 1–loop term A(1)gg,Q has already been given in Eqs. (4.132, 4.135). In case of A (2) gg,Q, the part γˆ(1)gg = 8CFTF N8 + 4N7 + 8N6 + 6N5 − 3N4 − 22N3 − 10N2 − 8N − 8 (N − 1)N3(N + 1)3(N + 2) + 32CATF 9 { −5S1 + 3N6 + 9N5 + 22N4 + 29N3 + 41N2 + 28N + 6 (N − 1)N2(N + 1)2(N + 2) } (6.66) of the 2–loop anomalous dimension is additionally needed. As for A(2)Qg, the massive parts of the gluon self–energy contribute, Eqs. (4.84, 4.85). The unrenormalized OME at the 2–loop level is then given in terms of reducible and irreducible contributions via ˆˆA (2) gg,Q = ˆˆA (2),irred gg,Q − ˆˆA (1) gg,QΠˆ (1) ( 0, mˆ 2 µ2 ) − Πˆ(2) ( 0, mˆ 2 µ2 ) . (6.67) 90 In the unrenormalized result, we observe the same pole structure as predicted in Eq. (4.133). The constant and O(ε) contributions a(2)gg,Q and a (2) gg,Q are a(2)gg,Q = TFCA { −8 3 ζ2S1 + 16(N2 +N + 1)ζ2 3(N − 1)N(N + 1)(N + 2) − 4 56N + 47 27(N + 1)S1 + 2P16 27(N − 1)N3(N + 1)3(N + 2) } +TFCF { 4(N2 +N + 2)2ζ2 (N − 1)N2(N + 1)2(N + 2) − P17 (N − 1)N4(N + 1)4(N + 2) } , (6.68) a(2)gg,Q = TFCA { −8 9 ζ3S1 − 20 9 ζ2S1 + 16(N2 +N + 1) 9(N − 1)N(N + 1)(N + 2)ζ3 + 2N + 1 3(N + 1)S2 − S 2 1 3(N + 1) − 2 328N4 + 256N3 − 247N2 − 175N + 54 81(N − 1)N(N + 1)2 S1 + 4P18ζ2 9(N − 1)N2(N + 1)2(N + 2) + P19 81(N − 1)N4(N + 1)4(N + 2) } +TFCF { 4(N2 +N + 2)2ζ3 3(N − 1)N2(N + 1)2(N + 2) + P20ζ2 (N − 1)N3(N + 1)3(N + 2) + P21 4(N − 1)N5(N + 1)5(N + 2) } , (6.69) P16 = 15N8 + 60N7 + 572N6 + 1470N5 + 2135N4 +1794N3 + 722N2 − 24N − 72 , (6.70) P17 = 15N10 + 75N9 + 112N8 + 14N7 − 61N6 + 107N5 + 170N4 + 36N3 −36N2 − 32N − 16 , (6.71) P18 = 3N6 + 9N5 + 22N4 + 29N3 + 41N2 + 28N + 6 , (6.72) P19 = 3N10 + 15N9 + 3316N8 + 12778N7 + 22951N6 + 23815N5 + 14212N4 +3556N3 − 30N2 + 288N + 216 , (6.73) P20 = N8 + 4N7 + 8N6 + 6N5 − 3N4 − 22N3 − 10N2 − 8N − 8 , (6.74) P21 = 31N12 + 186N11 + 435N10 + 438N9 − 123N8 − 1170N7 − 1527N6 −654N5 + 88N4 − 136N2 − 96N − 32 . (6.75) We agree with the result for a(2)gg,Q given in [129], which is presented in Eq. (6.68). The new term a(2)gg,Q, Eq. (6.69), contributes to all OMEs A (3) ij through renormalization. The renormalized OME is then given by Eq. (4.136). Since this OME already emerges at LO, the O(a2s) term changes replacing the MOM– by the MS–scheme. The second moment in the MS–scheme reads AMSgg,Q = aMSs { 4 3 TF ln (m2 µ2 )} + aMSs 2 { TF [ −22 9 CA + 16 9 CF + 16 9 TF ] ln2 (m2 µ2 ) 91 + TF [70 27 CA + 148 27 CF ] ln (m2 µ2 ) + 7 9 CATF − 1352 81 CFTF } +O(aMSs 3 ) . (6.76) In the MOM–scheme it is given by AMOMgg,Q = aMOMs { 4 3 TF ln (m2 µ2 )} + aMOMs 2 { TF [ −22 9 CA + 16 9 CF ] ln2 (m2 µ2 ) + TF [70 27 CA + 148 27 CF ] ln (m2 µ2 ) + 7 9 CATF − 1352 81 CFTF } +O(aMOMs 3) .(6.77) The difference between the schemes reads A(2),MSgg,Q = A (2),MOM gg,Q + β20,Q ln2 (m2 µ2 ) . (6.78) The need for applying intermediately the MOM–scheme for renormalization becomes ob- vious again for the term A(2)gg,Q. As in the NS–case, renormalization in the MS–scheme for the coupling constant does not cancel all singularities. The remaining term is A(2)gq,Q, which emerges for the first time at O(a2s) and the same result is obtained in the MS– and MOM–schemes. The corresponding NLO anomalous dimension is given by γˆ(1)gq = 32CFTF 3 { − (N 2 +N + 2)S1 (N − 1)N(N + 1) + 8N3 + 13N2 + 27N + 16 3(N − 1)N(N + 1)2 } . (6.79) Again, we obtain the pole terms as predicted in Eq. (4.123). The constant and O(ε) contributions a(2)gq,Q and a (2) gq,Q then read a(2)gq,Q = TFCF { 4 3 N2 +N + 2 (N − 1)N(N + 1) ( 2ζ2 + S2 + S21 ) −8 9 8N3 + 13N2 + 27N + 16 (N − 1)N(N + 1)2 S1 + 8 27 P22 (N − 1)N(N + 1)3 } , (6.80) a(2)gq,Q = TFCF { 2 9 N2 +N + 2 (N − 1)N(N + 1) ( −2S3 − 3S2S1 − S31 + 4ζ3 − 6ζ2S1 ) + 2 9 8N3 + 13N2 + 27N + 16 (N − 1)N(N + 1)2 ( 2ζ2 + S2 + S21 ) − 4 27 P22S1 (N − 1)N(N + 1)3 + 4 81 P23 (N − 1)N(N + 1)4 } , (6.81) with P22 = 43N4 + 105N3 + 224N2 + 230N + 86 (6.82) P23 = 248N5 + 863N4 + 1927N3 + 2582N2 + 1820N + 496 . (6.83) The second moment of the renormalized result, cf. Eq. (4.125), reads AMSgq,Q = aMSs 2 { 32 9 ln2 (m2 µ2 ) + 208 27 ln (m2 µ2 ) + 236 27 } CFTF +O(aMSs 3 ) . (6.84) 92 We agree with the result for a(2)gq,Q given in [129], which is presented in (6.80). Let us summarize so far. In this Section, we newly calculated the O(ε) terms of the 2–loop massive OMEs. We additionally recalculated for the first time the terms a(2)gg,Q, Eq. (6.68), and a(2)gq,Q, Eq. (6.80), which were given in Ref. [129] and find full agreement. For completeness, we showed as well the terms a(2),NSqq,Q , a (2),PS Qq and a (2) Qg, which have been calculated for the first time in Ref. [126] and were recalculated in Refs. [128, 284]. The latter terms contribute to the heavy flavor Wilson coefficients in deeply inelastic scattering to the non power-suppressed contributions at O(a2s). In the renormalization of the heavy flavor Wilson coefficients to 3–loop order, all these terms contribute together with lower order single pole terms. The O(a2sε) contributions form parts of the constant terms of the 3–loop heavy flavor unpolarized operator matrix elements needed to describe the 3–loop heavy flavor Wilson coefficients in the region Q2 ≫ m2. The mathematical structure of our results is as follows. The terms a(2)ij can be ex- pressed in terms of polynomials of the basic nested harmonic sums up to weight w = 4 and derivatives thereof. They belong to the complexity-class of the general two-loop Wilson coefficients or hard scattering cross sections in massless QED and QCD and are described by six basic functions and their derivatives in Mellin space. Their analytic con- tinuation to complex values of N is known in explicit form. The package Sigma, [151–154], proved to be a useful tool to solve the sums occurring in the present problem and was extended accordingly by its author. 6.4 Checks on the Calculation There are several checks which we can use for our results. First of all, the terms up to O(ε0) have been calculated in Refs. [126, 129] and we agree with all unrenormalized results. As described in Sections 6.1, 6.2, we keep the complete ε–dependence until we expand the summand of the finite or infinite sums, which serves as a consistency check on the O(ε) results. Another test is provided by the sum rules in Eqs. (3.37, 3.38) for N = 2, which are fulfilled by the renormalized OMEs presented here and in Refs. [126, 129]. These rules are obeyed regardless of the renormalization scheme. We observe that they hold on the unrenormalized level as well, even up to O(ε). For the term A(2)Qg, we evaluated fixed moments of N for the contributing unrenormal- ized diagrams using the Mellin0-Barnes method, [305–307], cf. also Appendix C.3. Here, we used an extension of a method developed for massless propagators in Ref. [308] to massive on–shell operator matrix elements, [158, 287, 289]. The Mellin–Barnes integrals are then evaluated numerically using the package MB, [309]. Using this method, we cal- culated the even moments N = 2, 4, 6, 8 and agree with the corresponding fixed moments of our all–N result 25. For the first moment of the Abelian part of the unrenormalized term ˆˆA (2) Qg, there exists even another check. After analytic continuation from the even values of N to N ǫ C is performed, one may consider the limit N → 1. In this procedure the term (1+ (−1)N)/2 equals to 1. At O(a2s) the terms ∝ TFCA contain 1/z contributions in momentum fraction space and their first moment diverges. For the other contributions to the unrenormalized 25In Table 2 of Ref. [137], the moments N = 2 and N = 6 for the more difficult two–loop diagrams are presented. 93 operator matrix element, after mass renormalization to 2–loop order, the first moment is related to the Abelian part of the transverse contribution to the gluon propagator ΠV (p2,m2)|p2=0, except the term ∝ T 2F which results from wave function renormalization. This was shown in [126] up to the constant term in ε. One obtains ΠˆV (p2,m2) = aˆsTF Πˆ(1)V (p2,m2) + aˆ2sCFTF Πˆ (2) V (p2,m2) +O(aˆ3s) , (6.85) with lim p2→0 Πˆ(1)V (p2,m2) = 1 2 ˆˆA (1),N=1 Qg (6.86) lim p2→0 Πˆ(2)V (p2,m2) = 1 2 ˆˆA (2),N=1 Qg |CF . (6.87) Here, we extend the relation to the linear terms in ε. For the first moment the double pole contributions in ε vanish in Eq. (6.87). We compare with the corresponding QED– expression for the photon–propagator, ΠV,(k)T , which has been obtained in Ref. [310]. Due to the transition from QED to QCD, the relative color factor at the 2–loop level has to be adjusted to 1/4 = 1/(CFCA). After asymptotic expansion in m2/p2, the comparison can be performed up to the linear term in ε. One obtains lim p2→0 1 p2 Πˆ V,(1) T (p2,m2) = 1 2TF ˆˆA (1),N=1 Qg = − (m2 µ2 )ε/2 [ 8 3ε + ε 3 ζ2 ] (6.88) lim p2→0 1 p2 Πˆ V,(2) T (p2,m2) = 1 2TFCF ˆˆA (2),N=1 Qg |CF = (m2 µ2 )ε [ −4ε + 15− ( 31 4 + ζ2 ) ε ] . (6.89) Additionally, we notice that the renormalized results do not anymore contain ζ2–terms. The renormalized terms in Eqs. (4.95, 4.101, 4.114, 4.125, 4.136) contain expressions pro- portional to ζ2 in the non–logarithmic contributions, which just cancel the corresponding ζ2–terms in a(2)ij , cf. Eqs. (6.34, 6.53, 6.60, 6.68, 6.80). For explicit examples of this cancellation, one may compare the second moments of the renormalized OMEs presented in Eqs. (6.49, 6.50, 6.57, 6.63, 6.76, 6.77, 6.84). The latter provides no stringent test, but is in accordance with general observations made in higher loop calculations, namely that even ζ–values cancel for massless calculations in even dimensions in the renormalized results if presented in the MS–scheme, [311]. In the present work, this observation holds for the ζ2–terms in a single–scale massive calculation as well. The most powerful test is provided by the FORM–based program MATAD, [164], which we used to calculate fixed moments of the 2–loop OMEs up to O(ε). The setup is the same as in the 3–loop case and is explained in the next Section. At the 2–loop level we worked in general Rξ–gauges and explicitly observe the cancellation of the gauge parameter. For the terms A(2)Qg, A (2) gg we used both projection operators given in Eqs. (4.22, 4.23), which serves as another consistency check. In the singlet case, we calculated the even moments N = 2, 4, ..., 12 and found full agreement with the results presented in this Section up to O(ε). The same holds in the non–singlet case, where we calculated the odd moments as well, N = 1, 2, 3, ..., 12. 94 7 Calculation of Moments at O(a3s) In this Chapter, we describe the computation of the 3–loop corrections to the massive operator matrix elements in detail, cf. [134]. Typical Feynman diagrams contributing for the different processes are shown in Figure 10, where ⊗ denotes the corresponding composite operator insertions, cf. Appendix B. The generation of these diagrams with the FORTRAN–based program QGRAF, [161], is described in Section 7.1 along with the subsequent steps to prepare the input for the FORM–based program MATAD, [164]. The latter allows the calculation of massive tadpole integrals in D dimensions up to three loops and relies on the MINCER algorithm, [312, 313]. The use of MATAD and the projection onto fixed moments are explained in Section 7.2. Finally, we present our results for the fixed moments of the 3–loop OMEs and the fermionic contributions to the anomalous dimensions in Section 7.3. The calculation is mainly performed using FORM programs while in a few cases codes have also been written in MAPLE. (NS) (PSH) (PSl) (qgH) (qgl) (gq) (gg) ghost Figure 10: Examples for 3–loop diagrams contributing to the massive operator matrix ele- ments: NS - non–singlet, PSH,l - pure–singlet, singlet qgH,l, gq, gg and ghost contributions. Here the coupling of the gauge boson to a heavy or light fermion line is labeled by H and l, respectively. Thick lines: heavy quarks, curly lines: gluons, full lines: quarks, dashed lines: ghosts. 7.1 Generation of Diagrams QGRAF is a quite general program to generate Feynman diagrams and allows to spec- ify various kinds of particles and interactions. Our main issue is to generate diagrams which contain composite operator insertions, cf. (2.86)–(2.88) and Appendix B, as spe- cial vertices. To give an example, let us consider the contributions to A(1)Qg. Within the light–cone expansion, Section 2.3, this term derives from the Born diagrams squared of the photon–gluon fusion process shown in Figure 11, cf. Section 3.1 and Figure 6. Figure 11: Diagrams contributing to H(1)g,(2,L) via the optical theorem. Wavy lines: photons; curly lines: gluons; full lines: quarks. 95 After expanding these diagrams with respect to the virtuality of the photon, the mass effects are given by the diagrams in Figure 12. These are obtained by contracting the lines between the external photons. Figure 12: Diagrams contributing to A(1)Qg. Thus, one may think of the operator insertion as being coupled to two external particles, an incoming and an outgoing one, which carry the same momentum. Therefore, one defines in the model file of QGRAF vertices which resemble the operator insertions in this manner, using a scalar field φ, which shall not propagate in order to ensure that there is only one of these vertices for each diagram. For the quarkonic operators, one defines the vertices φ+ φ+ q + q + n g , 0 ≤ n ≤ 3 , (7.1) which is illustrated in Figure 13. .... ︸ ︷︷ ︸ n =⇒ .... ︸ ︷︷ ︸ n φ , p2 φ , p2 Figure 13: Generation of the operator insertion. The same procedure can be used for the purely gluonic interactions and one defines in this case φ+ φ+ n g , 0 ≤ n ≤ 4 . (7.2) The Green’s functions we have to consider and their relation to the respective OMEs were given in Eqs. (4.18)–(4.21). The number of diagrams we obtain contributing to each OME is shown in Table 7.1. Term # Term # Term # Term # A(3)Qg 1358 A (3) qg,Q 140 A (3),PS Qq 125 A (3),PS qq,Q 8 A(3),NSqq,Q 129 A (3) gq,Q 89 A (3) gg,Q 886 Table 2: Number of diagrams contributing to the 3–loop massive OMEs. 96 The next step consists in rewriting the output provided by QGRAF in such a way, that the Feynman rules given in Appendix B can be inserted. Thus, one has to introduce Lorentz and color indices and align the fermion lines. Additionally, the integration momenta have to be written in such a way that MATAD can handle them. For the latter step, all information on the types of particles, the operator insertion and the external momentum are irrelevant, leading to only two basic topologies to be considered at the 2–loop level, which are shown in Figure 14. p1 p3 p2 p1 p2 Figure 14: 2–Loop topologies for MATAD, indicating labeling of momenta. Note, that in the case at hand the topology on the right–hand side of Figure 14 always yields zero after integration. At the 3–loop level, the master topology is given in Figure 15. p2 p6 p4 p3 p5 p1 Figure 15: Master 3–loop topology for MATAD, indicating labeling of momenta. From this topology, five types of diagrams are derived by shrinking various lines. These diagrams are shown in Figure 16. Finally the projectors given in Eqs. (4.22, 4.24) are applied to project onto the scalar massive OMEs. We only use the physical projector (4.23) as a check for lower moments, since it causes a significant increase of the computation time. To calculate the color factor of each diagram, we use the program provided in Ref. [163] and for the calculation of fermion traces we use FORM. Up to this point, all operations have been performed for general values of Mellin N and the dimensional parameter ε. The integrals do not contain any Lorentz or color indices anymore. In order to use MATAD, one now has to assign to N a specific value. Additionally, the unphysical momentum ∆ has to be replaced by a suitable projector, which we define in the following Section. 97 p2 p1 p3 p5 p6 p2 p1 p3 p3 p6 p2 p6 p3 p3 p1 p5 p2 p6 p3 p5 p2 p3 p3 p6 Figure 16: Additional 3–loop topologies for MATAD. 7.2 Calculation of Fixed 3–Loop Moments Using MATAD We consider integrals of the type Il(p,m, n1 . . . nj) ≡ ∫ dDk1 (2π)D . . . ∫ dDkl (2π)D (∆.q1) n1 . . . (∆.qj)njf(k1 . . . kl, p,m) . (7.3) Here p denotes the external momentum, p2 = 0, m is the heavy quark mass, and ∆ is a light–like vector, ∆2 = 0. The momenta qi are given by any linear combination of the loop momenta ki and external momentum p. The exponents ni are integers or possibly sums of integers, see the Feynman rules in Appendix B. Their sum is given by j∑ i=1 ni = N . (7.4) The function f in Eq. (7.3) contains propagators, of which at least one is massive, dot- products of its arguments and powers of m. If one sets N = 0, (7.3) is given by Il(p,m, 0 . . . 0) = Il(m) = ∫ dDk1 (2π)D . . . ∫ dDkl (2π)D f(k1 . . . kl,m) . (7.5) From p2 = 0 it follows, that the result can not depend on p anymore. The above integral is a massive tadpole integral and thus of the type MATAD can process. Additionally, MATAD can calculate the integral up to a given order as a power series in p2/m2. Let us return to the general integral given in Eq. (7.3). One notes, that for fixed moments of N , each integral of this type splits up into one or more integrals of the same type with the ni having fixed integer values. At this point, it is useful to recall that the auxiliary vector ∆ has only been introduced to get rid of the trace terms of the expectation values of the composite operators and has no physical significance. By undoing the contraction 98 with ∆, these trace terms appear again. Consider as an example Il(p,m, 2, 1) = ∫ dDk1 (2π)D . . . ∫ dDkl (2π)D (∆.q1) 2(∆.q2)f(k1 . . . kl, p,m) (7.6) = ∆µ1∆µ2∆µ3 ∫ dDk1 (2π)D . . . ∫ dDkl (2π)D q1,µ1q1,µ2q2,µ3f(k1 . . . kl, p,m) . (7.7) One notices that the way of distributing the indices in Eq. (7.7) is somewhat arbitrary, since after the contraction with the totally symmetric tensor ∆µ1∆µ2∆µ3 only the com- pletely symmetric part of the corresponding tensor integral contributes. This is made explicit by distributing the indices among the qi in all possible ways and dividing by the number of permutations one has used. Thus Eq. (7.7) is written as Il(p,m, 2, 1) = ∆µ1∆µ2∆µ3 1 3 ∫ dDk1 (2π)D . . . ∫ dDkl (2π)D (q1,µ2q1,µ3q2,µ1 + q1,µ1q1,µ3q2,µ2 +q1,µ1q1,µ2q2,µ3)f(k1 . . . kl, p,m) . (7.8) Generally speaking, the symmetrization of the tensor resulting from j∏ i=1 (∆.q1)ni (7.9) can be achieved by shuffling indices, [142, 143, 146, 155, 301, 314], and dividing by the number of terms. The shuffle product is given by C  (k1, . . . , k1)︸ ︷︷ ︸ n1 ⊔⊔ (k2, . . . , k2)︸ ︷︷ ︸ n2 ⊔⊔ . . . ⊔⊔ (kI , . . . , kI)︸ ︷︷ ︸ nI   , (7.10) where C is the normalization constant C = ( N n1, . . . , nI )−1 . (7.11) As an example, the symmetrization of q1,µ1q1,µ2q2,µ3 (7.12) can be inferred from Eq. (7.8). After undoing the contraction with ∆ in (7.3) and shuffling the indices, one may make the following ansatz for the result of this integral, which follows from the necessity of complete symmetry in the Lorentz indices R{µ1...µN} ≡ [N/2]+1∑ j=1 Aj (j−1∏ k=1 g{µ2kµ2k−1 )( N∏ l=2j−1 pµl} ) . (7.13) In the above equation, [ ] denotes the Gauss–bracket and {} symmetrization with respect to the indices enclosed and dividing by the number of terms, as outlined above. The first 99 few terms are then given by R0 ≡ 1 , (7.14) R{µ1} = A1pµ1 , (7.15) R{µ1µ2} = A1pµ1pµ2 + A2gµ1µ2 , (7.16) R{µ1µ2µ3} = A1pµ1pµ2pµ3 + A2g{µ1µ2pµ3} . (7.17) The scalars Aj have in general different mass dimensions. By contracting again with ∆, all trace terms vanish and one obtains Il(p,m, n1 . . . nj) = ∆µ1 . . .∆µNR{µ1...µN} (7.18) = A1(∆.p)N (7.19) and thus the coefficient A1 in Eq. (7.13) gives the desired result. To obtain it, one constructs a different projector, which is made up only of the external momentum p and the metric tensor. By making a general ansatz for this projector, applying it to Eq. (7.13) and demanding that the result shall be equal to A1, the coefficients of the different Lorentz structures can be determined. The projector reads Πµ1...µN = F (N) [N/2]+1∑ i=1 C(i, N) ([N/2]−i+1∏ l=1 gµ2l−1µ2l p2 )( N∏ k=2[N/2]−2i+3 pµk p2 ) . (7.20) For the overall pre-factors F (N) and the coefficients C(i, N), one has to distinguish be- tween even and odd values of N , Codd(k,N) = (−1)N/2+k+1/22 2k−N/2−3/2Γ(N + 1)Γ(D/2 +N/2 + k − 3/2) Γ(N/2− k + 3/2)Γ(2k)Γ(D/2 +N/2− 1/2) , (7.21) F odd(N) = 2 3/2−N/2Γ(D/2 + 1/2) (D − 1)Γ(N/2 +D/2− 1) , (7.22) Ceven(k,N) = (−1)N/2+k+1 2 2k−N/2−2Γ(N + 1)Γ(D/2 +N/2− 2 + k) Γ(N/2− k + 2)Γ(2k − 1)Γ(D/2 +N/2− 1) , (7.23) F even(N) = 2 1−N/2Γ(D/2 + 1/2) (D − 1)Γ(N/2 +D/2− 1/2) . (7.24) The projector obeys the normalization condition Πµ1...µNRµ1...µN = A1 , (7.25) which implies Πµ1...µNpµ1 . . . pµN = 1 . (7.26) (7.27) As an example for the above procedure, we consider the case N = 3, Πµ1µ2µ3 = 1 D − 1 ( −3gµ1µ2pµ3p4 + (D + 2) pµ1pµ2pµ3 p6 ) . (7.28) 100 Applying this term to (7.8) yields Il(p,m, 2, 1) = 1 (D − 1)p6 ∫ dDk1 (2π)D . . . ∫ dDkl (2π)D ( −2p2q1.q2p.q1 −p2q21p.q2 + (D + 2)(q1.p)2q2.p ) f(k1 . . . kl, p,m) . (7.29) Up to 3–loop integrals of the type (7.29) can be calculated by MATAD as a Taylor series in p2/m2. It is important to keep p artificially off–shell until the end of the calculation. By construction, the overall result will not contain any term ∝ 1/p2, since the integral one starts with is free of such terms. Thus, at the end, these terms have to cancel. The remaining constant term in p2 is the desired result. The above projectors are similar to the harmonic projectors used in the MINCER– program, cf. [313, 315]. These are, however, applied to the virtual forward Compton– amplitude to determine the anomalous dimensions and the moments of the massless Wil- son coefficients up to 3–loop order. The calculation was performed in Feynman gauge in general. Part of the calculation was carried out keeping the gauge parameter in Rξ–gauges, in particular for the moments N = 2, 4 in the singlet case and for N = 1, 2, 3, 4 in the non–singlet case, yielding agreement with the results being obtained using Feynman–gauge. In addition, for the moments N = 2, 4 in the terms with external gluons, we applied the physical projector in Eq. (4.23), which serves as another verification of our results. The computation of the more complicated diagrams was performed on various 32/64 Gb machines using FORM and for part of the calculation TFORM, [316], was used. The complete calculation required about 250 CPU days. 7.3 Results We calculated the unrenormalized operator matrix elements treating the 1PI-contributions explicitly. They contribute to A(3)Qg, A (3) gg,Q and A (3),NS qq,Q . One obtains the following represen- tations ˆˆA (3) Qg = ˆˆA (3),irr Qg − ˆˆA (2),irr Qg Πˆ (1) ( 0, mˆ 2 µ2 ) − ˆˆA (1) QgΠˆ (2) ( 0, mˆ 2 µ2 ) + ˆˆA (1) QgΠˆ (1) ( 0, mˆ 2 µ2 ) Πˆ(1) ( 0, mˆ 2 µ2 ) , (7.30) ˆˆA (3) gg,Q = ˆˆA (3),irr gg,Q − Πˆ(3) ( 0, mˆ 2 µ2 ) − ˆˆA (2),irr gg,Q Πˆ (1) ( 0, mˆ 2 µ2 ) −2 ˆˆA (1) gg,QΠˆ (2) ( 0, mˆ 2 µ2 ) + ˆˆA (1) gg,QΠˆ (1) ( 0, mˆ 2 µ2 ) Πˆ(1) ( 0, mˆ 2 µ2 ) , (7.31) ˆˆA (3),NS qq,Q = ˆˆA (3),NS,irr qq,Q − Σˆ(3) ( 0, mˆ 2 µ2 ) . (7.32) The self-energies are given in Eqs. (4.84, 4.85, 4.86, 4.88). The calculation of the one- particle irreducible 3–loop contributions is performed as described in the previous Sec- tion 26. The amount of moments, which could be calculated, depended on the available 26Partial results of the calculation were presented in [131,132]. 101 computer resources w.r.t. memory and computational time, as well as the possible par- allelization using TFORM. Increasing the Mellin moment from N → N + 2 demands both a factor of 6–8 larger memory and CPU time. We have calculated the even mo- ments N = 2, . . . , 10 for A(3)Qg, A (3) gg,Q, and A (3) qg,Q, for A (3),PS Qq up to N = 12, and for A(3),NSqq,Q , A (3),PS qq,Q , A (3) gq,Q up to N = 14. In the NS–case, we also calculated the odd moments N = 1, . . . , 13, which correspond to the NS−–terms. (i) Anomalous Dimensions : The pole terms of the unrenormalized OMEs emerging in the calculation agree with the general structure we presented in Eqs. (4.94, 4.103, 4.104, 4.116, 4.117, 4.124, 4.134). Using lower order renormalization coefficients and the constant terms of the 2–loop results, [126,128–130], allows to determine the fixed moments of the 2–loop anomalous dimensions and the contributions ∝ TF of the 3–loop anomalous dimensions, cf. Appendix E. All our results agree with the results of Refs. [111, 112, 124, 125, 317, 318]. The anomalous dimensions γ(2)qg and γ(2),PSqq are obtained completely. The present calculation is fully inde- pendent both in the algorithms and codes compared to Refs. [111, 112, 124, 125, 318] and thus provides a stringent check on these results. (ii) The constant terms a(3)ij (N): The constant terms at O(a3s), cf. Eqs. (4.94, 4.103, 4.104, 4.116, 4.117, 4.124, 4.134), are the new contributions to the non–logarithmic part of the 3–loop massive operator matrix elements, which can not be constructed by other renormalization constants cal- culated previously. They are given in Appendix F. All other contributions to the heavy flavor Wilson coefficients in the region Q2 ≫ m2 are known for general values of N , cf. Sections 4.7 and 6. The functions a(3)ij (N) still contain coefficients ∝ ζ2 and we will see below, under which circumstances these terms will contribute to the heavy flavor contri- butions to the deep–inelastic structure functions. The constant B4, (4.89), emerges as in other massive single–scale calculations, [279–282]. (iii) Moments of the Constant Terms of the 3–loop Massive OMEs The logarithmic terms of the renormalized 3–loop massive OMEs are determined by known renormalization constants and lower order contributions to the massive OMEs. They can be inferred from Eqs. (4.96, 4.105, 4.106, 4.118, 4.119, 4.126, 4.137). In the following, we consider as examples the non–logarithmic contributions to the second mo- ments of the renormalized massive OMEs. We refer to coupling constant renormalization in the MS–scheme and compare the results performing the mass renormalization in the on–shell–scheme (m) and the MS–scheme (m), cf. Section 5. For the matrix elements with external gluons, we obtain : A(3),MSQg (µ2 = m2, 2) = TFC2A ( 174055 4374 − 88 9 B4 + 72ζ4 − 29431 324 ζ3 ) +TFCFCA ( −18002 729 + 208 9 B4 − 104ζ4 + 2186 9 ζ3 − 64 3 ζ2 + 64ζ2 ln(2) ) 102 +TFC2F ( −8879 729 − 64 9 B4 + 32ζ4 − 701 81 ζ3 + 80ζ2 − 128ζ2 ln(2) ) +T 2FCA ( −21586 2187 + 3605 162 ζ3 ) + T 2FCF ( −55672 729 + 889 81 ζ3 + 128 3 ζ2 ) +nfT 2FCA ( −7054 2187 − 704 81 ζ3 ) + nfT 2FCF ( −22526 729 + 1024 81 ζ3 − 64 3 ζ2 ) . (7.33) A(3),MSQg (µ2 = m2, 2) = TFC2A ( 174055 4374 − 88 9 B4 + 72ζ4 − 29431 324 ζ3 ) +TFCFCA ( −123113 729 + 208 9 B4 − 104ζ4 + 2330 9 ζ3 ) + TFC2F ( −8042 729 − 64 9 B4 +32ζ4 − 3293 81 ζ3 ) + T 2FCA ( −21586 2187 + 3605 162 ζ3 ) + T 2FCF ( −9340 729 + 889 81 ζ3 ) +nfT 2FCA ( −7054 2187 − 704 81 ζ3 ) + nfT 2FCF ( 478 729 + 1024 81 ζ3 ) . (7.34) A(3),MSqg,Q (µ2 = m2, 2) = nfT 2FCA ( 64280 2187 − 704 81 ζ3 ) + nfT 2FCF ( −7382 729 + 1024 81 ζ3 ) . (7.35) A(3),MSgg,Q (µ2 = m2, 2) = TFC2A ( −174055 4374 + 88 9 B4 − 72ζ4 + 29431 324 ζ3 ) +TFCFCA ( 18002 729 − 208 9 B4 + 104ζ4 − 2186 9 ζ3 + 64 3 ζ2 − 64ζ2 ln(2) ) +TFC2F ( 8879 729 + 64 9 B4 − 32ζ4 + 701 81 ζ3 − 80ζ2 + 128ζ2 ln(2) ) +T 2FCA ( 21586 2187 − 3605 162 ζ3 ) + T 2FCF ( 55672 729 − 889 81 ζ3 − 128 3 ζ2 ) +nfT 2FCA ( −57226 2187 + 1408 81 ζ3 ) + nfT 2FCF ( 29908 729 − 2048 81 ζ3 + 64 3 ζ2 ) . (7.36) A(3),MSgg,Q (µ2 = m2, 2) = TFC2A ( −174055 4374 + 88 9 B4 − 72ζ4 + 29431 324 ζ3 ) +TFCFCA ( 123113 729 − 208 9 B4 + 104ζ4 − 2330 9 ζ3 ) + TFC2F ( 8042 729 + 64 9 B4 −32ζ4 + 3293 81 ζ3 ) + T 2FCA ( 21586 2187 − 3605 162 ζ3 ) + T 2FCF ( 9340 729 − 889 81 ζ3 ) 103 +nfT 2FCA ( −57226 2187 + 1408 81 ζ3 ) + nfT 2FCF ( 6904 729 − 2048 81 ζ3 ) . (7.37) Comparing the operator matrix elements in case of the on–shell–scheme and MS– scheme, one notices that the terms ln(2)ζ2 and ζ2 are absent in the latter. The ζ2 terms, which contribute to a(3)ij , are canceled by other contributions through renormalization. Although the present process is massive, this observation resembles the known result that ζ2–terms do not contribute in space–like massless higher order calculations in even dimen- sions, [311]. This behavior is found for all calculated moments. The occurring ζ4–terms may partly cancel with those in the 3–loop light Wilson coefficients, [115]. Note, that Eq. (7.35) is not sensitive to mass renormalization due to the structure of the contribut- ing diagrams. An additional check is provided by the sum rule (3.38), which is fulfilled in all renor- malization schemes and also on the unrenormalized level. Unlike the operator matrix elements with external gluons, the second moments of the quarkonic OMEs emerge for the first time at O(a2s). To 3–loop order, the renormalized quarkonic OMEs do not contain terms ∝ ζ2. Due to their simpler structure, mass renor- malization in the on–shell–scheme does not give rise to terms ∝ ζ2, ln(2)ζ2. Only the rational contribution in the color factor ∝ TFC2F turns out to be different compared to the on–mass–shell–scheme and APS,(3)qq,Q , (7.40), is not affected at all. This holds again for all moments we calculated. The non–logarithmic contributions are given by A(3),PS,MSQq (µ2 = m2, 2) = TFCFCA ( 830 2187 + 64 9 B4 − 64ζ4 + 1280 27 ζ3 ) +TFC2F ( 95638 729 − 128 9 B4 + 64ζ4 − 9536 81 ζ3 ) + T 2FCF ( 53144 2187 − 3584 81 ζ3 ) +nfT 2FCF ( −34312 2187 + 1024 81 ζ3 ) . (7.38) A(3),PS,MSQq (µ2 = m2, 2) = TFCFCA ( 830 2187 + 64 9 B4 − 64ζ4 + 1280 27 ζ3 ) +TFC2F ( 78358 729 − 128 9 B4 + 64ζ4 − 9536 81 ζ3 ) + T 2FCF ( 53144 2187 − 3584 81 ζ3 ) +nfT 2FCF ( −34312 2187 + 1024 81 ζ3 ) . (7.39) A(3),PS,MSqq,Q (µ2 = m2, 2) = nfT 2FCF ( −52168 2187 + 1024 81 ζ3 ) . (7.40) A(3),NS,MSqq,Q (µ2 = m2, 2) = TFCFCA ( −101944 2187 + 64 9 B4 − 64ζ4 + 4456 81 ζ3 ) +TFC2F ( 283964 2187 − 128 9 B4 + 64ζ4 − 848 9 ζ3 ) 104 +T 2FCF ( 25024 2187 − 1792 81 ζ3 ) + nfT 2FCF ( −46336 2187 + 1024 81 ζ3 ) . (7.41) A(3),NS,MSqq,Q (µ2 = m2, 2) = TFCFCA ( −101944 2187 + 64 9 B4 − 64ζ4 + 4456 81 ζ3 ) +TFC2F ( 201020 2187 − 128 9 B4 + 64ζ4 − 848 9 ζ3 ) +T 2FCF ( 25024 2187 − 1792 81 ζ3 ) + nfT 2FCF ( −46336 2187 + 1024 81 ζ3 ) . (7.42) A(3),MSgq,Q (µ2 = m2, 2) = TFCFCA ( 101114 2187 − 128 9 B4 + 128ζ4 − 8296 81 ζ3 ) +TFC2F ( −570878 2187 + 256 9 B4 − 128ζ4 + 17168 81 ζ3 ) +T 2FCF ( −26056 729 + 1792 27 ζ3 ) + nfT 2FCF ( 44272 729 − 1024 27 ζ3 ) . (7.43) A(3),MSgq,Q (µ2 = m2, 2) = TFCFCA ( 101114 2187 − 128 9 B4 + 128ζ4 − 8296 81 ζ3 ) +TFC2F ( −436094 2187 + 256 9 B4 − 128ζ4 + 17168 81 ζ3 ) +T 2FCF ( −26056 729 + 1792 27 ζ3 ) + nfT 2FCF ( 44272 729 − 1024 27 ζ3 ) . (7.44) Finally, the sum rule (3.38) holds on the unrenormalized level, as well as for the renor- malized expressions in all schemes considered. FORM–codes for the constant terms a(3)ij , Appendix F, and the corresponding moments of the renormalized massive operator matrix elements, both for the mass renormalization carried out in the on–shell– and MS–scheme, are attached to Ref. [134] and can be obtained upon request. Phenomenological studies of the 3–loop heavy flavor Wilson coefficients in the region Q2 ≫ m2 will be given elsewhere, [319]. 105 8 Heavy Flavor Corrections to Polarized Deep- Inelastic Scattering The composition of the proton spin in terms of partonic degrees of freedom has attracted much interest after the initial experimental finding, [320], that the polarization of the three light quarks alone does not add to the required value 1/2. Subsequently, the po- larized proton structure functions have been measured in great detail by various exper- iments, [321] 27. To determine the different contributions to the nucleon spin, both the flavor dependence as well as the contributions due to gluons and angular excitations at virtualities Q2 in the perturbative region have to be studied in more detail in the future. As the nucleon spin contributions are related to the first moments of the respective dis- tribution functions, it is desirable to measure to very small values of x at high energies, cf. [177,179,325]. A detailed treatment of the flavor structure requires the inclusion of heavy flavor. As in the unpolarized case, this contribution is driven by the gluon and sea–quark densities. Exclusive data on charm–quark pair production in polarized deep–inelastic scattering are available only in the region of very low photon virtualities at present, [326]. However, the inclusive measurement of the structure functions g1(x,Q2) and g2(x,Q2) contains the heavy flavor contributions for hadronic masses W 2 ≥ (2m+M)2. The polarized heavy flavor Wilson coefficients are known to first order in the whole kinematic range, [327–329]. In these references, numerical illustrations for the LO con- tributions were given as well, cf. also [202]. The polarized parton densities have been extracted from deep-inelastic scattering data in [330–333]. Unlike the case for photo- production, [334], the NLO Wilson coefficients have not been calculated for the whole kinematic domain, but only in the region Q2 ≫ m2, [165], applying the same technique as described in Section 3.2. As outlined in the same Section, the heavy flavor contributions to the structure function F2(x,Q2) are very well described by the asymptotic represen- tation for Q2/m2 >∼ 10, i.e., Q2 >∼ 22.5GeV2, in case of charm. A similar approximation should hold in case of the polarized structure function g1(x,Q2). In this chapter, we re-calculate for the first time the heavy flavor contributions to the longitudinally polarized structure function g1(x,Q2) to O(a2s) in the asymptotic region Q2 ≫ m2, [165]. The corresponding contributions to the structure function g2(x,Q2) can be obtained by using the Wandzura–Wilczek relation, [335], at the level of twist–2 operators, as has been shown in Refs. [195,200–202] within the covariant parton model. In the polarized case, the twist-2 heavy flavor Wilson coefficients factorize in the limit Q2 ≫ m2 in the same way as in the unpolarized case, cf. Section 3.2 and [165]. The corresponding light flavor Wilson coefficients were obtained in Ref. [336]. We proceed by calculating the 2–loop polarized massive quarkonic OMEs, as has been done in Ref. [165]. Additionally, we newly calculate the O(ε) terms of these objects, which will be needed to evaluate the O(a3s) corrections, cf. Section 4. The calculation is performed in the same way as described in Section 6 and we therefore only discuss aspects that are specific to the polarized case. The notation for the heavy flavor Wilson coefficients is the same as in Eq. (3.2) and below, except that the index (2, L) has to be replaced by (g1, g2). The polarized massive operator matrix elements are denoted by ∆Aij and obey the same relations as in Sections 3 and 4, if one replaces the 27For theoretical surveys see [322–324]. 106 anomalous dimensions, cf. Eq. (2.107, 2.108), by their polarized counterparts, ∆γij. The asymptotic heavy flavor corrections for polarized deeply inelastic scattering to O(a2s), [165], were calculated in a specific scheme for the treatment of γ5 in dimensional regularization. This was done in order to use the same scheme as has been applied in the calculation of the massless Wilson coefficients in [336]. Here, we refer to the version prior to an Erratum submitted in 2007, which connected the calculation to the MS–scheme. In this chapter we would like to compare to the results given in Ref. [165], which requires to apply the conventions used there. In Section 8.1, we summarize main relations such as the differential cross sections for polarized deeply inelastic scattering and the leading order heavy flavor corrections. We give a brief outline on the representation of the asymptotic heavy flavor corrections at NLO. In Sections (8.2.1)–(8.2.3), the contributions to the operator matrix elements ∆A(2),NSqq,Q , ∆A (2) Qg and ∆A PS,(2) Qq are calculated up to the linear terms in ε. 8.1 Polarized Scattering Cross Sections We consider the process of deeply inelastic longitudinally polarized charged lepton scat- tering off longitudinally (L) or transversely (T) polarized nucleons in case of single photon exchange 28. The differential scattering cross section is given by d3σ dxdydθ = yα2 Q4 L µνWµν , (8.1) cf. [201,323]. Here, θ is the azimuthal angle of the final state lepton. One may define an asymmetry between the differential cross sections for opposite nucleon polarization A(x, y, θ)L,T = d3σ→L,T dxdydθ − d3σ←L,T dxdydθ , (8.2) which projects onto the asymmetric part of both the leptonic and hadronic tensors, LAµν and WAµν . The hadronic tensor is then expressed by two nucleon structure functions WAµν = iεµνλσ [qλSσ P.q g1(x,Q 2) + qλ(P.qSσ − S.qP σ) (P.q)2 g2(x,Q 2) ] . (8.3) Here S denotes the nucleon’s spin vector SL = (0, 0, 0,M) ST = M(0, cos(θ¯), sin(θ¯), 0) , (8.4) with θ¯ a fixed angle in the plane transverse to the nucleon beam. εµνλσ is the Levi–Civita symbol. The asymmetries A(x, y, θ)L,T read A(x, y)L = 4λ α2 Q2 [( 2− y − 2xyM 2 s ) g1(x,Q2) + 4 yxM2 s g2(x,Q 2) ] , (8.5) A(x, y, θ¯, θ)T = −8λ α2 Q2 √ M2 s √ x y [ 1− y − xyM 2 S ] cos(θ¯ − θ)[yg1(x,Q2) +2g2(x,Q2)] , (8.6) 28For the basic kinematics of DIS, see Section 2.1. 107 where λ is the degree of polarization. In case of A(x, y)L, the azimuthal angle was inte- grated out, since the differential cross section depends on it only through phase space. The twist–2 heavy flavor contributions to the structure function g1(x,Q2) are cal- culated using the collinear parton model. This is not possible in case of the structure function g2(x,Q2). As has been shown in Ref. [202], the Wandzura–Wilczek relation holds for the gluonic heavy flavor contributions as well gτ=22 (x,Q2) = −gτ=21 (x,Q2) + ∫ 1 x dz z g τ=2 1 (z,Q2) , (8.7) from which g2(x,Q2) can be calculated for twist τ = 2. At leading order the heavy flavor corrections are known for the whole kinematic region, [327–329], gQQ1 (x,Q2,m2) = 4e2Qas ∫ 1 ax dz z H (1) g,g1 (x z , m2 Q2 ) ∆G(z, nf , Q2) (8.8) and are of the same structure as in the unpolarized case, cf. Eq. (3.12). Here, ∆G is the polarized gluon density. The LO heavy flavor Wilson coefficient then reads H(1)g,g1 ( τ, m 2 Q2 ) = 4TF [ v(3− 4τ) + (1− 2τ) ln ( 1− v 1 + v )] . (8.9) The support of H(1)g,g1 (τ,m2/Q2) is τ ǫ [0, 1/a]. As is well known, its first moment vanishes ∫ 1/a 0 dτH(1)g1 ( τ, m 2 Q2 ) = 0 , (8.10) which has a phenomenological implication on the heavy flavor contributions to polarized structure functions, resulting in an oscillatory profile, [202]. The unpolarized heavy flavor Wilson coefficients, [103,126,128,135,136,287,289], do not obey a relation like (8.10) but exhibit a rising behavior towards smaller values of x. At asymptotic values Q2 ≫ m2 one obtains H(1),asg,g1 ( τ, m 2 Q2 ) = 4TF [ (3− 4τ)− (1− 2τ) ln (Q2 m2 1− τ τ )] . (8.11) The factor in front of the logarithmic term ln(Q2/m2) in (8.11) is the leading order splitting function ∆Pqg(τ), [117,337] 29, ∆Pqg(τ) = 8TF [ τ 2 − (1− τ)2 ] = 8TF [2τ − 1] . (8.12) The sum–rule (8.10) also holds in the asymptotic case extending the range of integration to τ ǫ [0, 1], ∫ 1 0 dτH(1),asg,g1 ( τ, m 2 Q2 ) = 0 . (8.13) 29Early calculations of the leading order polarized singlet splitting functions in Refs. [337] still contained some errors. 108 8.2 Polarized Massive Operator Matrix Elements The asymptotic heavy flavor Wilson coefficients obey the same factorization relations in the limit Q2 ≫ m2 as in the unpolarized case, Eqs. (3.21)–(3.25), if one replaces all quantities by their polarized counterparts. The corresponding polarized twist–2 composite operators, cf. Eqs. (2.86)–(2.88), are given by ONSq,r;µ1,... ,µN = i N−1S[ψγ5γµ1Dµ2 . . . DµN λr 2 ψ]− trace terms , (8.14) OSq;µ1,... ,µN = i N−1S[ψγ5γµ1Dµ2 . . . DµNψ]− trace terms , (8.15) OSg;µ1,... ,µN = 2i N−2SSp[ 1 2 εµ1αβγF aβγDµ2 . . . DµN−1F µNα,a ]− trace terms . (8.16) The Feynman rules needed are given in Appendix B. The polarized anomalous dimensions of these operators are defined in the same way as in Eqs. (2.107, 2.108), as is the case for the polarized massive OMEs, cf. Eq. (3.17) and below. In the subsequent investigation, we will follow Ref. [165] and calculate the quarkonic heavy quark contributions to O(a2s). The diagrams contributing to the corresponding massive OMEs are the same as in the unpolarized case and are shown in Figures 1–4 in Ref. [126]. The formal factorization relations for the heavy flavor Wilson coefficients can be inferred from Eqs. (3.26, 3.29, 3.30). Here, we perform the calculation in the MOM–scheme, cf. Section 5.1, to account for heavy quarks in the final state only. The same scheme has been adopted in Ref. [165]. Identifying µ2 = Q2, the heavy flavor Wilson coefficients in the limit Q2 ≫ m2 become, [165], H(1)g,g1 (Q2 m2 , N ) = −1 2 ∆γˆ(0)qg ln (Q2 m2 ) + cˆ(1)g,g1 , (8.17) H(2)g,g1 (Q2 m2 , N ) = { 1 8 ∆γˆ(0)qg [ ∆γ(0)qq −∆γ(0)gg − 2β0 ] ln2 (Q2 m2 ) −1 2 [ ∆γˆ(1)qg +∆γˆ(0)qg c(1)q,g1 ] ln (Q2 m2 ) + [ ∆γ(0)gg −∆γ(0)qq + 2β0 ] ∆γˆ(0)qg ζ2 8 + cˆ(2)g,g1 +∆a (2) Qg } , (8.18) H(2),PSq,g1 (Q2 m2 , N ) = { −1 8 ∆γˆ(0)qg ∆γ(0)gq ln2 (Q2 m2 ) − 1 2 ∆γˆ(1),PSqq ln (Q2 m2 ) + ∆γˆ(0)qg ∆γ(0)gq 8 ζ2 + cˆ(2),PSq,g1 +∆a (2),PS Qq } , (8.19) L(2),NSq,g1 (Q2 m2 , N ) = { 1 4 β0,Q∆γ(0)qq ln2 (Q2 m2 ) − [ 1 2 ∆γˆ(1),NSqq + β0,Qc(1)q,g1 ] ln (Q2 m2 ) −1 4 β0,Qζ2∆γ(0)qq + cˆ (2),NS q,g1,Q +∆a (2),NS qq,Q } . (8.20) c(k)i,g1 are the kth order non–logarithmic terms of the polarized coefficient functions. As has been described in [165], the relations (8.18)–(8.20) hold if one uses the same scheme for 109 the description of γ5 in dimensional regularization for the massive OMEs and the light flavor Wilson coefficients. This is the case for the massive OMEs as calculated in [165], to which we refer, and the light flavor Wilson coefficients as calculated in Ref. [336]. 8.2.1 ∆A(2),NSqq,Q The non–singlet operator matrix element ∆A(2),NSqq,Q has to be the same as in the unpolarized case due to the Ward–Takahashi identity, [338]. Since it is obtained as zero–momentum insertion on a graph for the transition 〈p| → |p〉, one may write it equivalently in terms of the momentum derivative of the self–energy. The latter is independent of the operator insertion and yields therefore the same in case of /∆(∆.p)N−1 and /∆γ5(∆.p)N−1. Hence, ∆A(2),NSqq,Q reads, cf. Eq. (4.95), ∆A(2),NSqq,Q ( N, m 2 µ2 ) = A(2),NSqq,Q ( N, m 2 µ2 ) = β0,Qγ(0)qq 4 ln2 (m2 µ2 ) + γˆ(1),NSqq 2 ln (m2 µ2 ) + a(2),NSqq,Q − γ(0)qq 4 β0,Qζ2 , (8.21) where the constant term in ε of the unrenormalized result, Eq. (4.93), is given in Eq. (6.60) and the O(ε)–term in Eq. (6.61). 8.2.2 ∆A(2)Qg To calculate the OME ∆AQg up to O(a2s), the Dirac-matrix γ5 is represented in D = 4+ε dimensions via, [165,264,339], /∆γ5 = i 6 εµνρσ∆µγνγργσ . (8.22) The Levi–Civita symbol will be contracted later with a second Levi–Civita symbol emerg- ing in the general expression for the Green’s function, cf. Eq. (4.18), ∆GˆabQ,µν = ∆ ˆˆAQg (mˆ2 µ2 , ε, N ) δab(∆ · p)N−1εµναβ∆αpβ , (8.23) by using the following relation in D–dimensions, [194], εµνρσεαλτγ = −Det [ gβω ] , (8.24) β = α, λ, τ, γ , ω = µ, ν, ρ, σ . In particular, anti–symmetry relations of the Levi-Civita tensor or the relation γ25 = 1, holding in four dimensions, are not used. The projector for the gluonic OME then reads ∆ ˆˆAQg = δab N2c − 1 1 (D − 2)(D − 3)(∆.p) −N−1εµνρσ∆GˆabQ,µν∆ρpσ . (8.25) In the following, we will present the results for the operator matrix element using the above prescription for γ5. This representation allows a direct comparison to Ref. [165] despite the 110 fact that in this scheme even some of the anomalous dimensions are not those of the MS– scheme. We will discuss operator matrix elements for which only mass renormalization was carried out, cf. Section 4.3. Due to the crossing relations of the forward Compton amplitude corresponding to the polarized case, only odd moments contribute. Therefore the overall factor 1 2 [ 1− (−1)N ] , N ∈ N, (8.26) is implied in the following. To obtain the results in x–space the analytic continuation to complex values of N can be performed starting from the odd integers. The O(as) calculation is straightforward ∆ ˆˆA (1) Qg = (m2 µ2 )ε/2 [1 ε + ζ2 8 ε2 + ζ3 24 ε ] ∆γˆ(0)qg +O(ε3) (8.27) = (m2 µ2 )ε/2 [1 ε∆γˆ (0) qg +∆a (1) Qg + ε∆a (1) Qg + ε2∆a (1) Qg ] +O(ε3) . (8.28) The matrix element contains the leading order anomalous dimension ∆γˆ(0)qg , ∆A(1)Qg = 1 2 ∆γˆ(0)qg ln (m2 µ2 ) , (8.29) where ∆γˆ(0)qg = −8TF N − 1 N(N + 1) . (8.30) The leading order polarized Wilson coefficient c(1)g,g1 reads, [329,336,340], c(1)g,g1 = −4TF N − 1 N(N + 1) [ S1 + N − 1 N ] . (8.31) The Mellin transform of Eq. (8.11) then yields the same expression as one obtains from Eq. (8.17) H(1),asg,g1 ( N, m 2 Q2 ) = [ −1 2 ∆γˆ(0)qg ln (Q2 m2 ) + c(1)g,g1 ] , (8.32) for which the proportionality H(1),asg,g1 ( N, m 2 Q2 ) ∝ (N − 1) (8.33) holds, leading to a vanishing first moment. At the 2–loop level, we express the operator matrix element ∆ ˆˆA (2) Qg, after mass renor- malization, in terms of anomalous dimensions, cf. [126,128,135,136,287,289], by ∆ ˆˆA (2) Qg = (m2 µ2 )ε [ ∆γˆ(0)qg 2ε2 { ∆γ(0)qq −∆γ(0)gg − 2β0 } + ∆γˆ′(1)qg ε +∆a ′(2) Qg +∆a ′(2) Qg ε ] −2εβ0,Q (m2 µ2 )ε/2 ( 1 + ε2 8 ζ2 + ε3 24 ζ3 ) ∆ ˆˆA (1) Qg +O(ε2) , (8.34) 111 The remaining LO anomalous dimensions are ∆γ(0)qq = −CF ( −8S1 + 2 3N2 + 3N + 2 N(N + 1) ) , (8.35) ∆γ(0)gg = −CA ( −8S1 + 2 11N2 + 11N + 24 3N(N + 1) ) + 8 3 TFnf . (8.36) The renormalized expression in the MOM–scheme is given by ∆A′(2),MOMQg = ∆γˆ(0)qg 8 [ ∆γ(0)qq −∆γ(0)gg − 2β0 ] ln2 (m2 µ2 ) + γˆ′(1)qg 2 ln (m2 µ2 ) + ( ∆γ(0)gg −∆γ(0)qq + 2β0 ) γˆ(0)qg 8 ζ2 +∆a′(2)Qg . (8.37) The LO anomalous dimensions which enter the double pole term in Eq. (8.34) and the ln2(m2/µ2) term in Eq. (8.37), respectively, are scheme–independent. This is not the case for the remaining terms, which depend on the particular scheme we adopted in Eqs. (8.24, 8.22) and are therefore denoted by a prime. The NLO anomalous dimension we obtain is given by ∆γˆ′(1)qg = −TFCF ( −16 N − 1N(N + 1)S2 + 16 N − 1 N(N + 1)S 2 1 − 32 N − 1 N2(N + 1)S1 +8 (N − 1)(5N4 + 10N3 + 8N2 + 7N + 2) N3(N + 1)3 ) +TFCA ( 32 N − 1 N(N + 1)β ′ + 16 N − 1 N(N + 1)S2 + 16 N − 1 N(N + 1)S 2 1 −16 N − 1N(N + 1)ζ2 − 64S1 N(N + 1)2 − 16 N5 +N4 − 4N3 + 3N2 − 7N − 2 N3(N + 1)3 ) . (8.38) It differs from the result in the MS–scheme, [341,342], by a finite renormalization. This is due to the fact that we contracted the Levi–Civita symbols in D dimensions. The correct NLO splitting function is obtained by ∆γˆ(1)qg = ∆γˆ′(1)qg + 64TFCF N − 1 N2(N + 1)2 . (8.39) In an earlier version of Ref. [336], ∆γˆ′(1)qg was used as the anomalous dimension departing from the MS scheme. Therefore, in Ref. [165] the finite renormalization (8.39), as the corresponding one for c(2)g,g1 , [336], was not used for the calculation of ∆A(2)Qg. For the 112 higher order terms in ε in Eq. (8.34) we obtain ∆a′(2)Qg = −TFCF { 4(N − 1) 3N(N + 1) ( −4S3 + S31 + 3S1S2 + 6S1ζ2 ) − 4(3N 2 + 3N − 2)S21 N2(N + 1)(N + 2) −4N 4 + 17N3 + 43N2 + 33N + 2 N2(N + 1)2(N + 2) S2 − 2 (N − 1)(3N2 + 3N + 2) N2(N + 1)2 ζ2 −4N 3 − 2N2 − 22N − 36 N2(N + 1)(N + 2) S1 + 2P1 N4(N + 1)4(N + 2) } −TFCA { 4 N − 1 3N(N + 1) ( 12M [ Li2(x) 1 + x ] (N + 1) + 3β′′ − 8S3 − S31 − 9S1S2 −12S1β′ − 12βζ2 − 3ζ3 ) − 16 N − 1N(N + 1)2β ′ + 4 N2 + 4N + 5 N(N + 1)2(N + 2)S 2 1 +4 7N3 + 24N2 + 15N − 16 N2(N + 1)2(N + 2) S2 + 8 (N − 1)(N + 2) N2(N + 1)2 ζ2 +4 N4 + 4N3 −N2 − 10N + 2 N(N + 1)3(N + 2) S1 − 4P2 N4(N + 1)4(N + 2) } , (8.40) ∆a′(2)Qg = TFCF { N − 1 N(N + 1) ( 16S2,1,1 − 8S3,1 − 8S2,1S1 + 3S4 − 4 3 S3S1 − 1 2 S22 − 1 6 S41 −8 3 S1ζ3 − S2S21 + 2S2ζ2 − 2S21ζ2 ) − 8S2,1N2 + 3N2 + 3N − 2 N2(N + 1)(N + 2) ( 2S2S1 + 2 3 S31 ) +2 3N4 + 48N3 + 123N2 + 98N + 8 3N2(N + 1)2(2 +N) S3 + 4(N − 1) N2(N + 1)S1ζ2 + 2 3 (N − 1)(3N2 + 3N + 2) N2(N + 1)2 ζ3 + P3S2 N3(N + 1)3(N + 2) + N3 − 6N2 − 22N − 36 N2(N + 1)(N + 2) S 2 1 + P4ζ2 N3(N + 1)3 − 2 2N4 − 4N3 − 3N2 + 20N + 12 N2(N + 1)2(N + 2) S1 + P5 N5(N + 1)5(N + 2) } +TFCA { N − 1 N(N + 1) ( 16S−2,1,1 − 4S2,1,1 − 8S−3,1 − 8S−2,2 − 4S3,1 + 2 3 β′′′ −16S−2,1S1 − 4β′′S1 + 8β′S2 + 8β′S21 + 9S4 + 40 3 S3S1 + 1 2 S22 + 5S2S21 + 1 6 S41 +4ζ2β′ − 2ζ2S2 − 2ζ2S21 − 10 3 S1ζ3 − 17 5 ζ22 ) − N − 1N(N + 1)2 ( 16S−2,1 + 4β′′ − 16β′S1 ) −16 3 N3 + 7N2 + 8N − 6 N2(N + 1)2(N + 2) S3 + 2(3N2 − 13)S2S1 N(N + 1)2(N + 2) − 2(N2 + 4N + 5) 3N(N + 1)2(N + 2)S 3 1 − 8ζ2S1 (N + 1)2 − 2 3 (N − 1)(9N + 8) N2(N + 1)2 ζ3 − 8(N2 + 3) N(N + 1)3β ′ − P6S2N3(N + 1)3(N + 2) −N 4 + 2N3 − 5N2 − 12N + 2 N(N + 1)3(N + 2) S 2 1 − 2P7ζ2 N3(N + 1)3 + 2P8S1 N(N + 1)4(N + 2) − 2P9N5(N + 1)5(N + 2) } , (8.41) 113 with the polynomials P1 = 4N8 + 12N7 + 4N6 − 32N5 − 55N4 − 30N3 − 3N2 − 8N − 4 , (8.42) P2 = 2N8 + 10N7 + 22N6 + 36N5 + 29N4 + 4N3 + 33N2 + 12N + 4 , (8.43) P3 = 3N6 + 30N5 + 107N4 + 124N3 + 48N2 + 20N + 8 , (8.44) P4 = (N − 1)(7N4 + 14N3 + 4N2 − 7N − 2) , (8.45) P5 = 8N10 + 24N9 − 11N8 − 160N7 − 311N6 − 275N5 − 111N4 − 7N3 +11N2 + 12N + 4 , (8.46) P6 = N6 + 18N5 + 63N4 + 84N3 + 30N2 − 64N − 16 , (8.47) P7 = N5 −N4 − 4N3 − 3N2 − 7N − 2 , (8.48) P8 = 2N5 + 10N4 + 29N3 + 64N2 + 67N + 8 , (8.49) P9 = 4N10 + 22N9 + 45N8 + 36N7 − 11N6 − 15N5 + 25N4 − 41N3 −21N2 − 16N − 4 . (8.50) The Mellin–transform in Eq. (8.40) is given in Eq. (6.47) in terms of harmonic sums. As a check, we calculated several lower moments (N = 1 . . . 9) of each individual diagram contributing to A(2)Qg 30 using the Mellin–Barnes method, [287,309]. In Table 3, we present the numerical results we obtain for the moments N = 3, 7 of the individual diagrams. We agree with the results obtained for general values of N . The contributions from the individual diagrams are given in [159]. Our results up to O(ε0), Eqs. (8.34, 8.40), agree with the results presented in [165], which we thereby confirm for the first time. Eq. (8.41) is a new result. In this calculation extensive, use was made of the representation of the Feynman- parameter integrals in terms of generalized hypergeometric functions, cf. Section 6. The infinite sums, which occur in the polarized calculation, are widely the same as in the unpolarized case, [128,135,136,287,289]. The structure of the result for the higher order terms in ε is completely the same as in the unpolarized case as well, see Eq. (6.34) and the following discussion. Especially, the structural relations between the finite harmonic sums, [138, 144, 147, 148], allow to express ∆a′(2)Qg by only two basic Mellin transforms, S1 and S−2,1. This has to be compared to the 24 functions needed in Ref. [165] to express the constant term in z–space. Thus we reached a more compact representation. ∆a′(2)Qg depends on the six sums S1(N), S±2,1(N), S−3,1(N), S±2,1,1(N), after applying the structural relations. The O(ε0) term has the same complexity as the 2–loop anomalous dimensions, whereas the complexity of the O(ε) term corresponds to the level observed for 2–loop Wilson coefficients and other hard scattering processes which depend on a single scale, cf. [95, 145]. 8.2.3 ∆A(2),PSQq The operator matrix element ∆A(2),PSQq is obtained from the diagrams shown in Figure 3 of Ref. [126]. In this calculation, we did not adopt any specific scheme for γ5, but calculated the corresponding integrals without performing any traces or (anti)commuting γ5. 30These are shown in Figure 2 of Ref. [126]. 114 order 1/ε2 1/ε 1 ε ε2 A N = 3 −0.22222 0.06481 −0.13343 −0.15367 −0.06208 N = 7 −0.03061 0.00409 −0.01669 −0.01900 −0.00639 B N = 3 4.44444 −1.07407 4.45579 0.515535 3.13754 N = 7 5.46122 0.74491 6.09646 2.97092 5.35587 C N = 3 1.33333 −8.14444 0.13303 −6.55515 −2.64601 N = 7 0.85714 −5.12329 0.14342 −4.10768 −1.59526 D N = 3 2.66666 −0.02222 2.19940 1.03927 1.69331 N = 7 1.71428 0.85340 1.78773 1.56227 1.80130 E N = 3 −2.66667 5 −2.27719 4.89957 0.73208 N = 7 −1.71429 2.97857 −1.3471 2.83548 0.44608 F N = 3 0 0.77777 −5.80092 −2.63560 −6.57334 N = 7 0 1.40105 −3.54227 −0.78565 −3.72466 L N = 3 −9.33333 0.25000 −8.83933 −3.25228 −6.84460 N = 7 −6.73878 −1.86855 −7.09938 −4.56051 −6.501 M N = 3 −0.22222 0.71296 −0.41198 0.69938 −0.11618 N = 7 −0.03061 0.11324 −0.05861 0.11969 −0.01207 N N = 3 −2.22222 1.26851 −1.37562 0.69748 −0.36030 N = 7 −3.19184 −0.50674 −3.39832 −1.7667 −2.97339 Table 3: Numerical values for moments of individual diagrams of ∆ ˆˆA (2) Qg. The result can then be represented in terms of three bi–spinor structures C1(ε) = 1 ∆.pTr { /∆ /pγµγνγ5 } /∆γµγν = 24 3 + ε/∆γ5 (8.51) C2(ε) = Tr { /∆γµγνγργ5 } γµγνγρ = 24/∆γ5 (8.52) C3(ε) = 1 m2Tr { /∆ /pγµγνγ5 } /pγµγν . (8.53) These are placed between the states 〈p| . . . |p〉, with /p|p〉 = m0|p〉 (8.54) and m0 the light quark mass. Therefore, the contribution due to C3(ε) vanishes in the limit m0 → 0. The results for C1,2(ε) in the r.h.s. of Eqs. (8.51, 8.52) can be obtained by 115 applying the projector −3 2(D − 1)(D − 2)(D − 3)Tr[ /pγ5 Ci] (8.55) and performing the trace in D–dimensions using relations (8.22, 8.24). Note that the result in 4–dimensions is recovered by setting ε = 0. One obtains from the truncated 2–loop Green’s function ∆ Gij,(2)Qq ∆ Gij,(2)Qq = ∆ ˆˆA (2),PS Qq /∆γ5δij(∆.p)N−1 , (8.56) the following result for the massive OME ∆ ˆˆA (2),PS Qq /∆γ5 = (m2 µ2 )ε C(ε)8(N + 2) { − 1ε2 2(N − 1) N2(N + 1)2 + 1 ε N3 + 2N + 1 N3(N + 1)3 −(N − 1)(ζ2 + 2S2) 2N2(N + 1)2 − 4N3 − 4N2 − 3N − 1 2N4(N + 1)4 + ε [(N3 + 2N + 1)(ζ2 + 2S2) 4N3(N + 1)3 −(N − 1)(ζ3 + 3S3) 6N2(N + 1)2 + N5 − 7N4 + 6N3 + 7N2 + 4N + 1 4N5(N + 1)5 ]} +O(ε2) , (8.57) where C(ε) = C1(ε) · (N − 1) + C2(ε) 8(N + 2) = /∆γ5 3(N + 2 + ε) (N + 2)(3 + ε) = 1 + N − 1 3(N + 2) ( −ε+ ε 2 3 − ε 3 9 ) +O(ε4) . (8.58) Comparing our result, Eq. (8.57), to the result obtained in [165], one notices that there the factor C(ε) was calculated in 4–dimensions, i.e. C(ε) = 1. Therefore, we do the same and obtain ∆ ˆˆA (2),PS Qq = S2ε (m2 µ2 )ε [ −∆γˆ (0) qg ∆γ(0)gq 2ε2 + ∆γˆ(1),PSqq 2ε +∆a (2),PS Qq +∆a (2),PS Qq ε ] . (8.59) with ∆γ(0)gq = −4CF N + 2 N(N + 1) , (8.60) ∆γˆ(1),PSqq = 16TFCF (N + 2)(N3 + 2N + 1) N3(N + 1)3 , (8.61) ∆a(2),PSQq = − (N − 1)(ζ2 + 2S2) 2N2(N + 1)2 − 4N3 − 4N2 − 3N − 1 2N4(N + 1)4 , (8.62) ∆a(2),PSQq = − (N − 1)(ζ3 + 3S3) 6N2(N + 1)2 (N3 + 2N + 1)(ζ2 + 2S2) 4N3(N + 1)3 + N5 − 7N4 + 6N3 + 7N2 + 4N + 1 4N5(N + 1)5 . (8.63) 116 Here, we agree up to O(ε0) with Ref. [165] and Eq. (8.63) is a new result. Note, that Eq. (8.61) is already the MS anomalous dimension as obtained in Refs. [341,342]. There- fore any additional scheme dependence due to γ5 can only be contained in the higher order terms in ε. As a comparison the anomalous dimension ∆γˆ′(1),PSqq which is obtained by calculating C(ε) in D dimensions, is related to the MS one by ∆γˆ(1),PSqq = ∆γˆ′(1),PSqq − TFCF 16(N − 1)2 3N2(N + 1)2 . (8.64) The renormalized result becomes ∆A(2),PSQq = − ∆γˆ(0)qg ∆γ(0)gq 8 ln2 (m2 µ2 ) + ∆γˆ(1),PSqq 2 ln (m2 µ2 ) +∆a(2),PSQq + ∆γˆ(0)qg ∆γ(0)gq 8 ζ2 . (8.65) The results in this Section constitute a partial step towards the calculation of the asymp- totic heavy flavor contributions at O(a2s) in the MS–scheme, thereby going beyond the results of Ref. [165]. The same holds for the O(a2sε)–terms, which we calculated for the first time, using the same description for γ5 as has been done in [165]. The correct finite renormalization to transform to the MS–scheme remains to be worked out and will be presented elsewhere, [159]. 117 9 Heavy Flavor Contributions to Transversity The transversity distribution ∆Tf(x,Q2) is one of the three possible quarkonic twist-2 parton distributions besides the unpolarized and the longitudinally polarized quark dis- tribution, f(x,Q2) and ∆f(x,Q2), respectively. Unlike the latter distribution functions, it cannot be measured in inclusive deeply inelastic scattering in case of massless partons since it is chirally odd. However, it can be extracted from semi–inclusive deep-inelastic scattering (SIDIS) studying isolated meson production, [343, 344], and in the Drell-Yan process, [344–346], off transversely polarized targets 31. Measurements of the transversity distribution in different polarized hard scattering processes are currently performed or in preparation, [347]. In the past, phenomenological models for the transversity distribu- tion were developed based on bag-like models, chiral models, light–cone models, spectator models, and non-perturbative QCD calculations, cf. Section 8 of Ref. [166]. The main characteristics of the transversity distributions are that they vanish by some power law both at small and large values of Bjorken–x and exhibit a shifted bell-like shape. Recent attempts to extract the distribution out of data were made in Refs. [348]. The moments of the transversity distribution can be measured in lattice simulations, which help to constrain it ab initio, where first results were given in Refs. [192,349]. From these investi- gations there is evidence, that the up-quark distribution is positive while the down-quark distribution is negative, with first moments between {0.85 . . . 1.0} and {−0.20 . . .−0.24}, respectively. This is in qualitative agreement with phenomenological fits. Some of the processes which have been proposed to measure transversity contain k⊥− and higher twist effects, cf. [166]. We will limit our considerations to the class of purely twist–2 contributions, for which the formalism to calculate the heavy flavor corrections is established, cf. Section 3. As for the unpolarized flavor non–singlet contributions, we apply the factorization relation of the heavy flavor Wilson coefficient (3.21) in the region Q2 ≫ m2. As physical processes one may consider the SIDIS process lN → l′h+X off transversely polarized targets in which the transverse momentum of the produced final state hadron h is integrated. The differential scattering cross section in case of single photon exchange reads d3σ dxdydz = 4πα2 xyQ2 ∑ i=q,q e2ix { 1 2 [ 1 + (1− y)2 ] Fi(x,Q2)D˜i(z,Q2) −(1− y)|S⊥||Sh⊥| cos (φS + φSh)∆TFi(x,Q2)∆T D˜i(z,Q2) } . (9.1) Here, in addition to the Bjorken variables x and y, the fragmentation variable z occurs. S⊥ and Sh⊥ are the transverse spin vectors of the incoming nucleon N and the measured hadron h. The angles φS,Sh are measured in the plane perpendicular to the γ∗N (z–) axis between the x-axis and the respective vector. The transversity distribution can be obtained from Eq. (9.1) for a transversely polarized hadron h by measuring its polarization. 31For a review see Ref. [166]. 118 The functions Fi, D˜i,∆TFi,∆T D˜i are given by Fi(x,Q2) = Ci(x,Q2)⊗ fi(x,Q2) (9.2) D˜i(z,Q2) = C˜i(z,Q2)⊗Di(z,Q2) (9.3) ∆TFi(x,Q2) = ∆TCi(x,Q2)⊗∆Tfi(x,Q2) (9.4) ∆T D˜i(z,Q2) = ∆T C˜i(z,Q2)⊗∆TDi(z,Q2) . (9.5) Here, Di,∆TDi are the fragmentation functions and C˜i, ∆TCi, ∆T C˜i are the corresponding space- and time-like Wilson coefficients. The functions Ci are the Wilson coefficients as have been considered in the unpolarized case, cf. Sections 2 and 3. The Wilson coefficient for transversity, ∆TCi(x,Q2), contains light– and heavy flavor contributions, cf. Eq. (3.3), ∆TCi(x,Q2) = ∆TCi(x,Q2) + ∆THi(x,Q2) . (9.6) ∆TCi denotes the light flavor transversity Wilson coefficient and ∆THi(x,Q2) the heavy flavor part. We dropped arguments of the type nf , m2, µ2 for brevity, since they can all be inferred from the discussion in Section 3. Eq. (9.1) holds for spin–1/2 hadrons in the final state, but the transversity distribution may also be measured in the leptoproduction process of spin–1 hadrons, [350]. In this case, the Ph⊥-integrated Born cross section reads d3σ dxdydz = 4πα2 xyQ2 sin (φS + φSLT ) |S⊥||SLT |(1− y) ∑ i=q,q e2ix∆TFi(x,Q2)Ĥi,1,LT (z,Q2) . (9.7) Here, the polarization state of a spin–1 particle is described by a tensor with five inde- pendent components, [351]. φLT denotes the azimuthal angle of ~SLT , with |SLT | = √ (SxLT ) 2 + (SyLT ) 2 . (9.8) Ĥa,1,LT (z,Q2) is a T - and chirally odd twist-2 fragmentation function at vanishing k⊥. The process (9.7) has the advantage that the transverse polarization of the produced hadron can be measured from its decay products. The transversity distribution can also be measured in the transversely polarized Drell– Yan process, see Refs. [352–354]. However, the SIDIS processes have the advantage that in high luminosity experiments the heavy flavor contributions can be tagged like in deep- inelastic scattering. This is not the case for the Drell-Yan process, where the heavy flavor effects appear as inclusive radiative corrections in the Wilson coefficients only. The same argument as in Section 3.2 can be applied to obtain the heavy flavor Wilson coefficients for transversity in the asymptotic limit Q2 ≫ m2. Since transversity is a NS quantity, the relation is the same as in the unpolarized NS case and reads up to O(a3s), cf. Eq. (3.26), ∆THAsymq (nf + 1) = a2s [ ∆TA(2),NSqq,Q (nf + 1) + ∆T Cˆ(2)q (nf ) ] + a3s [ ∆TA(3),NSqq,Q (nf + 1) + ∆TA (2),NS qq,Q (nf + 1)∆TC(1)q (nf + 1) +∆T Cˆ(3)q (nf ) ] . (9.9) 119 The operator matrix elements ∆TA(2,3),NSqq,Q are – as in the unpolarized case – universal and account for all mass contributions but power corrections. The respective asymptotic heavy flavor Wilson coefficients are obtained in combination with the light flavor process– dependent Wilson coefficients 32. In the following, we will concentrate on the calculation of the massive operator matrix elements. The twist–2 local operator in case of transversity has a different Lorentz–structure compared to Eqs. (2.86)–(2.88) and is given by OTR,NSq,r;µ,µ1,... ,µN = i N−1S[ψσµµ1Dµ2 . . . DµN λr 2 ψ]− trace terms , (9.10) with σνµ = (i/2) [γνγµ − γµγν ] and the definition of the massive operator matrix element is the same as in Section 3.2. Since (9.10) denotes a twist–2 flavor non–singlet operator, it does not mix with other operators. After multiplying with the external source JN , cf. Eq. (4.10) and below, the Green’s function in momentum space corresponding to the transversity operator between quarkonic states is given by u(p, s)Gij,TR,NSµ,q,Q λru(p, s) = JN〈Ψi(p) | OTR,NSq,r;µ,µ1,... ,µN | Ψ j(p)〉Q . (9.11) It relates to the unrenormalized transversity OME via Gˆij,TR,NSµ,q,Q = δij(∆ · p)N−1 ( ∆ρσµρ∆T ˆˆA NS qq,Q (mˆ2 µ2 , ε, N ) + c1∆µ + c2pµ + c3γµp/ +c4∆/ p/∆µ + c5∆/ p/pµ ) . (9.12) The Feynman rules for the operators multiplied with the external source are given in Appendix B. The projection onto the massive OME is found to be ∆T ˆˆA NS qq,Q (mˆ2 µ2 , ε, N ) = − iδ ij 4Nc(∆.p)2(D − 2) { Tr[∆/ p/ pµGˆij,TR,NSµ,q,Q ]−∆.pTr[pµGˆij,TR,NSµ,q,Q ] +i∆.pTr[σµρpρGˆij,TR,NSµ,q,Q ] } . (9.13) Renormalization for transversity proceeds in the same manner as in the NS–case. The structure of the unrenormalized expressions at the 2– and 3–loop level are the same as shown in Eqs. (4.93, 4.94), if one inserts the respective transversity anomalous dimensions. The expansion coefficients of the renormalized OME then read up to O(a3s) in the MS– scheme, cf. Eqs. (4.95, 4.96), ∆TA(2),NS,MSqq,Q = β0,Qγ(0),TRqq 4 ln2 (m2 µ2 ) + γˆ(1),TRqq 2 ln (m2 µ2 ) + a(2),TRqq,Q − β0,Qγ(0),TRqq 4 ζ2 , (9.14) ∆TA(3),NS,MSqq,Q = − γ(0),TRqq β0,Q 6 ( β0 + 2β0,Q ) ln3 (m2 µ2 ) + 1 4 { 2γ(1),TRqq β0,Q 32Apparently, the light flavor Wilson coefficients for SIDIS were not yet calculated even at O(as), although this calculation and the corresponding soft-exponentiation should be straightforward. For the transversely polarized Drell-Yan process the O(as) light flavor Wilson coefficients were given in [353] and higher order terms due to soft resummation were derived in [354]. 120 −2γˆ(1),TRqq ( β0 + β0,Q ) + β1,Qγ(0),TRqq } ln2 (m2 µ2 ) + 1 2 { γˆ(2),TRqq − ( 4a(2),TRqq,Q − ζ2β0,Qγ(0),TRqq ) (β0 + β0,Q) + γ(0),TRqq β (1) 1,Q } ln (m2 µ2 ) +4a(2),TRqq,Q (β0 + β0,Q)− γ(0)qq β (2) 1,Q − γ(0),TRqq β0β0,Qζ3 6 − γ (1),TR qq β0,Qζ2 4 +2δm(1)1 β0,Qγ(0),TRqq + δm (0) 1 γˆ(1),TRqq + 2δm (−1) 1 a (2),TR qq,Q + a (3),TR qq,Q . (9.15) Here, γ(k),TRqq , {k = 0, 1, 2}, denote the transversity quark anomalous dimensions at O(ak+1s ) and a (2,3),TR qq,Q , a (2),TR qq,Q are the constant and O(ε) terms of the massive operator matrix element at 2– and 3–loop order, respectively, cf. the discussion in Section 4. At LO the transversity anomalous dimension was calculated in [345,355,356] 33, and at NLO in [353,358] 34. At three-loop order the moments N = 1 . . . 8 are known, [360]. The 2–loop calculation for allN proceeds in the same way as described in Section 6. We also calculated the unprojected Green’s function to check the projector (9.13). Fixed mo- ments at the 2– and 3–loop level were calculated using MATAD as described in Section 7. From the pole terms of the unrenormalized 2–loop OMEs, the leading and next-to-leading order anomalous dimensions γ(0),TRqq and γˆ(1),TRqq can be determined. We obtain γ(0),TRqq = 2CF [−3 + 4S1] , (9.16) and γˆ(1),TRqq = 32 9 CFTF [ 3S2 − 5S1 + 3 8 ] , (9.17) confirming earlier results, [353,358]. The finite and O(ε) contributions are given by a(2),TRqq,Q = CFTF { −8 3 S3 + 40 9 S2 − [ 224 27 + 8 3 ζ2 ] S1 + 2ζ2 + (24 + 73N + 73N2) 18N (N + 1) } , (9.18) a(2),TRqq,Q = CFTF { − [ 656 81 + 20 9 ζ2 + 8 9 ζ3 ] S1 + [ 112 27 + 4 3 ζ2 ] S2 − 20 9 S3 + 4 3 S4 + 1 6 ζ2 + 2 3 ζ3 + (−144− 48N + 757N2 + 1034N3 + 517N4) 216N2 (N + 1)2 } . (9.19) The renormalized 2–loop massive OME (9.14) reads ∆TA(2),NS,MSqq,Q = CFTF {[ −8 3 S1 + 2 ] ln2 (m2 µ2 ) + [ −80 9 S1 + 2 3 + 16 3 S2 ] ln (m2 µ2 ) −8 3 S3 + 40 9 S2 − 224 27 S1 + 24 + 73N + 73N2 18N (N + 1) } . (9.20) 33The small x limit of the LO anomalous dimension was calculated in [357]. 34For calculations in the non-forward case, see [356,359]. 121 Using MATAD, we calculated the moments N = 1 . . . 13 at O(a2s) and O(a3s). At the 2–loop level, we find complete agreement with the results presented in Eqs. (9.16)– (9.19). At O(a3s), we also obtain γˆ (2),TR qq , which can be compared to the TF -terms in the calculation [360] for N = 1...8. This is the first re-calculation of these terms and we find agreement. For the moments N = 9...13 this contribution to the transversity anomalous dimension is calculated for the first time. We list the anomalous dimensions in Appendix G. There, also the constant contributions a(3),TRqq,Q are given for N = 1 . . . 13, which is a new result. Furthermore, we obtain in the 3–loop calculation the moments N = 1...13 of the complete 2–loop anomalous dimensions. These are in accordance with Refs. [353,358]. Finally, we show as examples the first moments of the MS–renormalized O(a3s) massive transversity OME. Unlike the case for the vector current, the first moment does not vanish, since there is no conservation law to enforce this. ∆T A(3),NS,MSqq,Q (1) = CFTF {(16 27 TF (1− nf ) + 44 27 CA ) ln3 (m2 µ2 ) + (104 27 TF −106 9 CA + 32 3 CF ) ln2 (m2 µ2 ) + [ −604 81 nfTF − 4 3 TF + ( −2233 81 − 16ζ3 ) CA + ( 16ζ3 + 233 9 ) CF ] ln (m2 µ2 ) + ( −6556 729 + 128 27 ζ3 ) TFnf + (2746 729 − 224 27 ζ3 ) TF + (8 3 B4 + 437 27 ζ3 − 24ζ4 − 34135 729 ) CA + ( −16 3 B4 + 24ζ4 − 278 9 ζ3 + 7511 81 ) CF } , (9.21) ∆T A(3),NS,MSqq,Q (2) = CFTF {(16 9 TF (1− nf ) + 44 9 CA ) ln3 (m2 µ2 ) + ( −34 3 CA +8TF ) ln2 (m2 µ2 ) + [ −196 9 nfTF − 92 27 TF + ( −48ζ3 − 73 9 ) CA + ( 48ζ3 +15 ) CF ] ln (m2 µ2 ) + (128 9 ζ3 − 1988 81 ) TFnf + (338 27 − 224 9 ζ3 ) TF + ( −56 −72ζ4 + 8B4 + 533 9 ζ3 ) CA + ( −16B4 + 4133 27 + 72ζ4 − 310 3 ζ3 ) CF } . (9.22) The structure of the result and the contributing numbers are the same as in the unpo- larized case, cf. Eq. (7.41). We checked the moments N = 1 . . . 4 keeping the complete dependence on the gauge–parameter ξ and find that it cancels in the final result. Again, we observe that the massive OMEs do not depend on ζ2, cf. Section 7.3. Since the light flavor Wilson coefficients for the processes from which the transversity distribution can be extracted are not known to 2– and 3–loop order, phenomenological studies on the effect of the heavy flavor contributions cannot yet be performed. However, the results of this Section can be used in comparisons with upcoming lattice simulations with (2+1+1)-dynamical fermions including the charm quark. More details on this cal- culation are given in [160]. 122 10 First Steps Towards a Calculation of A(3)ij for all Moments. In Section 7, we described how the various massive OMEs are calculated for fixed integer values of the Mellin variable N at 3–loop order using MATAD. The ultimate goal is to calculate these quantities for general values of N . So far no massive single scale calculation at O(a3s) has been performed. In the following we would like to present some first results and a general method, which may be of use in later work calculating the general N– dependence of the massive OMEs A(3)ij . In Section 10.1, we solve, as an example, a 3–loop ladder graph contributing to A(3)Qg for general values of N by direct integration, avoiding the integration–by–parts method. In Section 10.2, Ref. [140,141], we discuss a general algorithm which allows to determine from a sufficiently large but finite number of moments for a recurrent quantity its general N–dependence. This algorithm has been successfully applied in [141] to reconstruct the 3–loop anomalous dimensions, [124, 125], and massless 3–loop Wilson coefficients, [115], from their moments. These are the largest single scale quantities known at the moment and are well suited to demonstrate the power of this formalism. Similarly, one may apply this method to new problems of smaller size which emerge in course of the calculation of the OMEs A(3)ij for general values of N . 10.1 Results for all–N Using Generalized Hypergeometric Functions In Section 6.1, we showed that there is only one basic 2–loop massive tadpole which needs to be considered. From it, all diagrams contributing to the massive 2–loop OMEs can be derived by attaching external quark–, gluon– and ghost–lines, respectively, and including one operator insertion according to the Feynman rules given in Appendix B. The corresponding parameter–integrals are then all of the same structure, Eq. (6.5). If one knows a method to calculate the basic topology for arbitrary integer powers of the propagators, the calculation of the 2–loop OMEs is straightforward for fixed values of N . In the general case, we arrived at infinite sums containing the parameter N . To calculate these sums, additional tools are needed, e.g. the program Sigma, cf. Section 6.2. (a) (b) (c) (d) Figure 17: Basic 3–loop topologies. Straight lines: quarks, curly lines: gluons. The gluon loop in (a) can also be replaced by a ghost loop. 123 We would like to follow the same approach in the 3–loop case. Here, five basic topologies need to considered, which are shown in Figures 17, 18. Diagram (a) and (b) – if one of the quark loops corresponds to a massless quark – can be reduced to 2–loop integrals, because the massless loop can be integrated trivially. For the remaining terms, this is not the case. Diagrams (c) and (d) are the most complex topologies, the former giving rise to the number B4, Eq. (4.89), whereas the latter yields single ζ–values up to weight 4, cf. e.g. [279]. Diagram (b) – if both quarks are massive – and (e) are ladder topologies and of less complexity. Let us, as an example, consider diagram (e). ν4 ν2 ν5 ν1 ν3 (e) Figure 18: 3–loop ladder graph Our notation is the same as in Section 6.1. The scalar D–dimensional integral corre- sponding to diagram (e) reads for arbitrary exponents of the propagators Te = ∫∫∫ dDqdDkdDl (2π)3D i(−1)ν12345(m2)ν12345−3D/2(4π)3D/2 (k2)ν1((k − l)2 −m2)ν2(l2 −m2)ν3((q − l)2 −m2)ν4(q2)ν5 . (10.1) Again, we have attached suitable normalization factors for convenience. After loop–by– loop integration of the momenta k, q, l (in this order) using Feynman–parameters, one obtains after a few steps the following parameter integral Te = Γ [ ν12345 − 6− 3ε/2 ν1, ν2, ν3, ν4, ν5 ] ∫ 1 0 dw1 . . . ∫ 1 0 dw4 θ(1− w1 − w2) w−3−ε/2+ν121 w −3−ε/2+ν45 2 (1− w1 − w2)ν3−1 (1 + w1 w3 1− w3 + w2 w4 1− w4 )ν12345−6−3ε/2 ×w1+ε/2−ν13 (1− w3)1+ε/2−ν2w 1+ε/2−ν5 4 (1− w4)1+ε/2−ν4 . (10.2) The θ–function enforces w1 + w2 ≤ 1. In order to perform the {w1, w2} integration, one considers I = ∫ 1 0 dw1 ∫ 1 0 dw2 θ(1− w1 − w2)wb−11 wb ′−1 2 (1− w1 − w2)c−b−b ′−1(1− w1x− w2y)−a . (10.3) 124 The parameters a, b, b′, c shall be such that this integral is convergent. It can be expressed in terms of the Appell function F1 via, [285] 35, I = Γ [ b, b′, c− b− b′ c ] ∞∑ m,n=0 (a)m+n(b)n(b′)m (1)m(1)n(c)m+n xnym (10.4) = Γ [ b, b′, c− b− b′ c ] F1 [ a; b, b′; c;x, y ] . (10.5) The parameters x, y correspond to w3/(1−w3) and w4/(1−w4) in Eq. (10.2), respectively. Hence the integral over these variables would yield a divergent sum. Therefore one uses the following analytic continuation relation for F1, [285], F1[a; b, b′; c; x x− 1 , y y − 1] = (1− x) b(1− y)b′F1[c− a; b, b′; c;x, y] . (10.6) Finally one arrives at an infinite double sum Te = Γ [ −2− ε/2 + ν12,−2− ε/2 + ν45,−6− 3ε/2 + ν12345 ν2, ν4,−4− ε+ ν12345 ] × ∞∑ m,n=0 Γ [ 2 +m+ ε/2− ν1, 2 + n+ ε/2− ν5 1 +m, 1 + n, 2 +m+ ε/2, 2 + n+ ε/2 ] ×(2 + ε/2)n+m(−2− ε/2 + ν12)m(−2− ε/2 + ν45)n (−4− ε+ ν12345)n+m . (10.7) Here, we have adopted the notation for the Γ–function defined in (C.8) and (a)b is Pochhammer’s symbol, Eq. (C.14). As one expects, Eq. (10.7) is symmetric w.r.t. ex- changes of the indices {ν1, ν2} ↔ {ν4, ν5}. For any values of νi of the type νi = ai + biε, with ai ∈ N, bi ∈ C, the Laurent–series in ε of Eq. (10.7) can be calculated using e.g. Summer, [143]. We have checked Eq. (10.7) for various values of the νi using MATAD, cf. Section 7.2. Next, let us consider the diagram shown in Figure 19, which contributes to A(3)Qg and derives from diagram (e). We treat the case where all exponents of the propagators are equal to one. p→ → p q q − p k k − p q − l k − l l l − p Figure 19: Example 3–loop graph 35Note that Eq. (8.2.2) of Ref. [285] contains typos. 125 Including the factor i(m2)2−3ε/2(4π)3D/2 and integrating q, k, l (in this order), we obtain Iex = Γ(2− 3ε/2) ∫ 1 0 dwi θ(1− w1 − w2) w−ε/21 w −ε/2 2 (1− w1 − w2) (1 + w1 1− w3 w3 + w2 1− w4 w4 )2−3ε/2 ×w−1+ε/23 (1− w3)ε/2w −1+ε/2 4 (1− w4)ε/2 ×(1− w5w1 − w6w2 − (1− w1 − w2)w7)N , (10.8) where all parameters w1 . . . w7 have to be integrated from 0 . . . 1. As in the 2–loop case, (6.5), one observes that the integral–kernel given by the corresponding massive tadpole integral (10.2) is multiplied with a polynomial containing various integration parameters to the power N . The same holds true for the remaining 3–loop diagrams. Hence, if a general sum representation for the corresponding tadpoles integrals is known and one knows how to evaluate the corresponding sums, at least fixed moments of the 3–loop massive OMEs can be calculated right away. The presence of the polynomial to the power N (which may also involve a finite sum, cf. the Feynman–rules in Appendix B,) complicates the calculation further. One has to find a suitable way to deal with this situation, which depends on the integral considered. For Iex, we split it up into several finite sums, rendering the integrals calculable in the same way as for Te. We obtain Iex = −Γ(2− 3ε/2) (N + 1)(N + 2)(N + 3) ∞∑ m,n=0 { N+2∑ t=1 ( 3 +N t ) (t− ε/2)m(2 +N + ε/2)n+m(3− t+N − ε/2)n (4 +N − ε)n+m ×Γ [ t, t− ε/2, 1 +m+ ε/2, 1 + n+ ε/2, 3− t+N, 3− t+N − ε/2 4 +N − ε, 1 +m, 1 + n, 1 + t+m+ ε/2, 4− t+ n+N + ε/2 ] − N+3∑ s=1 s−1∑ r=1 (s r )( 3 +N s ) (−1)s (r − ε/2)m(−1 + s+ ε/2)n+m(s− r − ε/2)n (1 + s− ε)n+m ×Γ [ r, r − ε/2, s− r, 1 +m+ ε/2, 1 + n+ ε/2, s− r − ε/2 1 +m, 1 + n, 1 + r +m+ ε/2, 1 + s− r + n+ ε/2, 1 + s− ε ]} . (10.9) After expanding in ε, the summation can be performed using Sigma and the summation techniques explained in Section 6.2. The result reads Iex = − 4(N + 1)S1 + 4 (N + 1)2(N + 2)ζ3 + 2S2,1,1 (N + 2)(N + 3) + 1 (N + 1)(N + 2)(N + 3) { −2(3N + 5)S3,1 − S14 4 + 4(N + 1)S1 − 4N N + 1 S2,1 + 2 ( (2N + 3)S1 + 5N + 6 N + 1 ) S3 + 9 + 4N 4 S22 + ( 2 7N + 11 (N + 1)(N + 2) + 5N N + 1S1 − 5 2 S12 ) S2 + 2(3N + 5)S12 (N + 1)(N + 2) + N N + 1S1 3 + 4(2N + 3)S1 (N + 1)2(N + 2) − (2N + 3)S4 2 + 8 2N + 3 (N + 1)3(N + 2) } +O(ε) , (10.10) 126 which agrees with the fixed moments N = 1 . . . 10 obtained using MATAD, cf. Section 7.2. We have shown that in principle one can be apply similar techniques as on the 2–loop level, Section 6.1, to calculate the massive 3–loop OMEs considering only the five basic topologies. In this approach the integration-by-parts method is not used. We have given the necessary formulas for one non–trivial topology (e) and showed for on of the cases there how the calculation proceeds keeping the all–N dependence. In order to obtain complete results for the massive OMEs, suitable integral representations for diagrams (b), (c) and (d) of Figure 17 have to be derived first. This will allow for a calculation of fixed moments not relying on MATAD. Next, an automatization of the step from (10.8) to (10.9) has to be found in order to obtain sums which can be handled e.g. by Sigma. The latter step is not trivial, since it depends on the respective diagram and the flow of the outer momentum p through it. 10.2 Reconstructing General–N Relations from a Finite Number of Mellin–Moments Higher order calculations in Quantum Field Theories easily become tedious due to the large number of terms emerging and the sophisticated form of the contributing Feynman parameter integrals. This applies already to zero scale and single scale quantities. Even more this is the case for problems containing at least two scales. While in the latter case the mathematical structure of the solution of the Feynman integrals is widely unknown, it is explored to a certain extent for zero- and single scale quantities. Zero scale quantities emerge as the expansion coefficients of the running couplings and masses, as fixed moments of splitting functions, etc.. They can be expressed by rational numbers and certain special numbers as multiple zeta-values (MZVs), [155,156] and related quantities. Single scale quantities depend on a scale z which may be given as a ratio of Lorentz invariants s′/s in the respective physical problem. One may perform a Mellin transform over z, Eq. (2.65). All subsequent calculations are then carried out in Mellin space and one assumes N ∈ N, N > 0. By this transformation, the problem at hand becomes discrete and one may seek a description in terms of difference equations, [292]. Zero scale problems are obtained from single scale problems treating N as a fixed integer or considering the limit N →∞. A main question concerning zero scale quantities is: Do the corresponding Feynman integrals always lead to MZVs? In the lower orders this is the case. However, starting at some order, even for single-mass problems, other special numbers will occur, [281, 361]. Since one has to known the respective basis completely, this makes it difficult to use methods like PSLQ, [362], to determine the analytic structure of the corresponding terms even if one may calculate them numerically at high enough precision. Zero scale problems are much easier to calculate than single scale problems. In some analogy to the determination of the analytic structure in zero scale problems through integer relations over a known basis (PSLQ) one may think of an automated reconstruction of the all–N relation out of a finite number of Mellin moments given in analytic form. This is possible for recurrent quantities. At least up to 3-loop order, presumably even to higher orders, single scale quantities belong to this class. Here we report on a general algorithm for this purpose, which we applied to the problem being currently the most sophisticated one: the anomalous dimensions and massless Wilson coefficients to 3–loop order for unpolarized 127 DIS, [115,124,125]. Details of our calculation are given in Refs. [140,141]. 10.2.1 Single Scale Feynman Integrals as Recurrent Quantities For a large variety of massless problems single scale Feynman integrals can be represented as polynomials in the ring formed by the nested harmonic sums, cf. Appendix C.4, and the MZVs ζa1,...,al , which we set equal to the σ–values defined in Eq. (C.35). Rational functions in N and harmonic sums obey recurrence relations. Thus, due to closure proper- ties, [363,364], also any polynomial expression in such terms is a solution of a recurrence. Consider as an example the recursion F (N + 1)− F (N) = sign(a) N+1 (N + 1)|a| . (10.11) It is solved by the harmonic sum Sa(N). Corresponding difference equations hold for harmonic sums of deeper nestedness. Feynman integrals can often be decomposed into a combination containing terms of the form ∫ 1 0 dz z N−1 − 1 1− z H~a(z), ∫ 1 0 dz (−z) N−1 − 1 1 + z H~a(z) , (10.12) with H~a(z) being a harmonic polylogarithm, [314]. This structure also leads to recur- rences, [365]. Therefore, it is very likely that single scale Feynman diagrams do always obey difference equations. 10.2.2 Establishing and Solving Recurrences Suppose we are given a finite array of rational numbers, q1, q2, . . . , qK , which are the first terms of an infinite sequence F (N), i.e., F (1) = q1, F (2) = q2, etc. Let us assume that F (N) represents a physical quantity and satisfies a recurrence of type l∑ k=0 ( d∑ i=0 ci,kN i ) F (N + k) = 0 , (10.13) which we would like to deduce from the given numbers qm. In a strict sense, this is not possible without knowing how the sequence continues for N > K. One thing we can do is to determine the recurrence equations satisfied by the data we are given. Any recurrence for F (N) must certainly be among those. To find the recurrence equations of F (N) valid for the first terms, the simplest way to proceed is by making an ansatz with undetermined coefficients. Let us fix an order l ∈ N and a degree d ∈ N and consider the generic recurrence (10.13), where the ci,k are unknown. For each specific choice N = 1, 2, . . . , K − l, we can evaluate the ansatz, because we know all the values of F (N+k) in this range, and we obtain a system of K− l homogeneous linear equations for (l + 1)(d+ 1) unknowns ci,j. If K − l > (l + 1)(d + 1), this system is under-determined and is thus guaranteed to have nontrivial solutions. All these solutions will be valid recurrences for F (N) for 128 N = 1, . . . , K − l, but they will most typically fail to hold beyond. If, on the other hand, K− l ≤ (l+1)(d+1), then the system is overdetermined and nontrivial solutions are not to be expected. But at least recurrence equations valid for all N , if there are any, must appear among the solutions. We therefore expect in this case that the solution set will precisely consist of the recurrences of F (N) of order l and degree d valid for all N . As an example, let us consider the contribution to the gluon splitting function ∝ CA at leading order, P (0)gg (N). The first 20 terms, starting with N = 3, of the sequence F (N) are 14 5 , 215 , 18135 , 8314 , 4129630 , 31945 , 261863465 , 184212310 , 75232790090 , 712038190 , 81163790090 , 12891113860 , 293211293063060 , 2508266 255255 , 29288626129099070 , 7045513684684 , 61125926958198140 , 1561447145860 , 4862237357446185740 , 98880845589237148 . Making an ansatz for a recurrence of order 3 with polynomial coefficients of degree 3 leads to an overdetermined homogeneous linear system with 16 unknowns and 17 equations. Despite of being overdetermined and dense, this system has two linearly independent solutions. Using bounds for the absolute value of determinants depending on the size of a matrix and the bit size of its coefficients, one can very roughly estimate the probability for this to happen “by coincidence” to about 10−65. And in fact, it did not happen by coincidence. The solutions to the system correspond to the two recurrence equations (7N3 + 113N2 + 494N + 592)F (N)− (12N3 + 233N2 + 1289N + 2156)F (N + 1) + (3N3 + 118N2 + 1021N + 2476)F (N + 2) + (2N3 + 2N2 − 226N − 912)F (N + 3) = 0 (10.14) and (4N3 + 64N2 + 278N + 332)F (N)− (7N3 + 134N2 + 735N + 1222)F (N + 1) + (2N3 + 71N2 + 595N + 1418)F (N + 2) + (N3 −N2 − 138N − 528)F (N + 3) = 0, (10.15) which both are valid for all N ≥ 1. If we had found that the linear system did not have a nontrivial solution, then we could have concluded that the sequence F (N) would definitely (i.e. without any uncertainty) not satisfy a recurrence of order 3 and degree 3. It might then still have satisfied recurrences with larger order or degree, but more terms of the sequence had to be known for detecting those. The method of determining (potential) recurrence equations for sequences as just de- scribed is not new. It is known to the experimental mathematics community as automated guessing and is frequently applied in the study of combinatorial sequences. Standard software packages for generating functions such as gfun [363] for MAPLE or Generating- Functions.m [364] for MATHEMATICA provide functions which take as input a finite array of numbers, thought of as the first terms of some infinite sequence, and produce as output recurrence equations that are, with high probability, satisfied by the infinite sequence. These packages apply the method described above more or less literally, and this is perfectly sufficient for small examples. But if thousands of terms of a sequence are needed, there is no way to solve the linear systems using rational number arithmetic. Even worse, already for medium sized problems from our collection, the size of the linear system exceeds by far typical memory capacities of 16–64Gb. Let us consider as an example the 129 difference equation associated to the contribution of the color factor C3F for the 3-loop Wilson coefficient C(3)2,q in unpolarized deeply inelastic scattering. 11 Tb of memory would be required to establish (10.13) in a naive way. Therefore refined methods have to be applied. We use arithmetic in finite fields together with Chinese remaindering, [366], which reduces the storage requirements to a few Gb of memory. The linear system approximately minimizes for l ≈ d. If one finds more than one recurrence the different recurrences are joined to reduce l to a minimal value. It seems to be a general phenomenon that the recurrence of minimal order is that with the smallest integer coefficients, cf. also [367]. For even larger problems than those dealt with in the present analysis, a series of further technical improvements may be carried out, [368]. For the solution of the recurrence low orders are clearly preferred. It is solved in depth- optimal ΠΣ fields, [152, 153, 296, 369, 370]; here we apply advanced symbolic summation methods as: efficient recurrence solvers and refined telescoping algorithms. They are available in the summation package Sigma, [153,154]. The solutions are found as linear combinations of rational terms in N combined with functions, which cannot be further reduced in the ΠΣ fields. In the present application they turn out to be nested harmonic sums, cf. Appendix C.4. Other or higher order applications may lead to sums of different type as well, which are uniquely found by the present algorithm. 10.2.3 Determination of the 3-Loop Anomalous Dimensions and Wilson Coefficients We apply the method to determine the unpolarized anomalous dimensions and massless Wilson coefficients to 3–loop order. Here we apply the above method to the contributions stemming from a single color/ζi-factor. These are 186 terms. As input we use the respec- tive Mellin moments, which were calculated by a MAPLE–code based on the harmonic sum representation calculated in Refs. [115, 124, 125]. We need very high moments and calculate the input recursively. As an example, let us illustrate the size of the moments for the C3F -contribution to the Wilson coefficient C (3) 2,q . The highest moment required is N = 5114. It cannot be calculated simply using Summer, [143], and we used a recursive algorithm in MAPLE for it. The corresponding difference equations (10.13) are determined by a recurrence finder. Furthermore, the order of the difference equation is reduced to the smallest value possible. The difference equations are then solved order by order using the summation package Sigma. For the C3F -term in C (3) q,2 , the recurrence was established after 20.7 days of CPU time. Here 4h were required for the modular prediction of the dimension of the system, 5.8 days were spent on solving modular linear systems, and 11 days for the modular operator GCDs. The Chinese remainder method and rational reconstruction took 3.8 days. 140 word size primes were needed. As output one obtains a recurrence of 31 Mb, which is of order 35 and degree 938, with a largest integer of 1227 digits. The recurrence was solved by Sigma after 5.9 days. We reached a compactification from 289 harmonic sums needed in [115,124,125] to 58 harmonic sums. The determination of the 3–loop anomalous dimensions is a much smaller problem. Here the computation takes only about 18 h for the complete result. For the three most complicated cases, establishing and solving of the difference equa- tions took 3 + 1 weeks each, requiring ≤ 10Gb on a 2 GHz processor. This led to an 130 overall computation time of about sixteen weeks. In the final representation, we account for algebraic reduction, [146]. For this task we used the package HarmonicSums, [371], which complements the functionality of Sigma. One observes that different color factor contributions lead to the same, or nearly the same, amount of sums for a given quantity. This points to the fact that the amount of sums contributing, after the algebraic reduction has been carried out, is governed by topology rather than the field- and color structures involved. The linear harmonic sum representations used in [115,124,125] require many more sums than in the representation reached by the present analysis. A further reduction can be obtained using the structural relations, which leads to maximally 35 different sums up to the level of the 3–loop Wilson coefficients, [147, 148, 365]. It is not unlikely that the present method can be applied to single scale problems in even higher orders. As has been found before in [126–128, 137, 138,145,259,365,372,373], representing a large number of 2- and 3-loop processes in terms of harmonic sums, the basis elements emerging are always the same. In practice no method does yet exist to calculate such a high number of moments ab initio as required for the determination of the all–N formulas in the 3–loop case. On the other hand, a proof of existence has been delivered of a quite general and powerful automatic difference-equation solver, standing rather demanding tests. It opens up good prospects for the development of even more powerful methods, which can be applied in establishing and solving difference equations for single scale quantities such as the classes of Feynman–parameter integrals contributing to the massive operator matrix elements for general values of N . 131 11 Conclusions In this thesis, we extended the description of the contributions of a single heavy quark to the unpolarized Wilson coefficients CS,PS,NS(q,g),2 to O(a3s). In upcoming precision analyzes of deep–inelastic data, this will allow more precise determinations of parton distribution functions and of the strong coupling constant. We applied a factorization relation for the complete inclusive heavy flavor Wilson coefficients, which holds in the limit Q2 ≫ 10m2 in case of F2(x,Q2), [126], at the level of twist–2. It relates the asymptotic heavy flavor Wilson coefficients to a convolution of the corresponding light flavor Wilson coefficients, which are known up to O(a3s), [115], and describe all process dependence, with the mas- sive operator matrix elements. The latter are process independent quantities and describe all mass–dependent contributions but the power–suppressed terms ((m2/Q2)k, k ≥ 1). They are obtained from the unpolarized twist–2 local composite operators stemming from the light–cone expansion of the electromagnetic current between on–shell partonic states, including virtual heavy quark lines. The first calculation of fixed moments of all 3–loop massive OMEs is the main result of this thesis. In Section 3.2, we applied the factorization formula at the O(a3s)–level. It holds for the inclusive heavy flavor Wilson coefficients, including radiative corrections due to heavy quark loops. In order to describe the production of heavy quarks in the final states only, further assumptions have to be made. This description succeeded at the 2–loop level in Ref. [126] because of the possible comparison with the exact calculation in Refs. [103] and since the contributing virtual heavy flavor corrections are easily identified, cf. Sec- tion 5.1. At O(a3s) this is not possible anymore and only the inclusive description should be used, as has been done in Ref. [129] in order to derive heavy flavor parton densities. These are obtained as convolutions of the light flavor densities with the massive OMEs, cf. Section 3.3. In Section 4, we derived and presented in detail the renormalization of the massive operator matrix elements up to O(a3s). This led to an intermediary representation in a defined MOM–scheme to maintain the partonic description required for the factorization of the heavy flavor Wilson coefficients into OMEs and the light flavor Wilson coefficients. Finally, we applied the MS–scheme for coupling constant renormalization in order to refer to the inclusive heavy flavor Wilson coefficients and to be able to combine our results with the light flavor Wilson coefficients, which have been calculated in the same scheme. For mass renormalization we chose the on–mass–shell–scheme and provided in Section 5 all necessary formulas to transform between the MOM– and the on–shell–scheme, respec- tively, and the MS–scheme. For renormalization at O(a3s), all O(a2s) massive OMEs AQg, APSQq, ANSqq,Q, Agg,Q, Agq,Q are needed up to O(ε) in dimensional regularization. In Section 6, we newly calculated all the corresponding O(ε) contributions in Mellin space for general values of N . This involved a first re–calculation of the complete terms A(2)gg,Q and A (2) gq,Q, in which we agree with the literature, [129]. We made use of the representation of the Feynman–parameter integrals in terms of generalized hypergeometric functions. The O(ε)–expansion led to new infinite sums which had to be solved by analytic and algebraic methods. The results can be expressed in terms of polynomials of the basic nested harmonic sums up to weight 132 w = 4 and derivatives thereof. They belong to the complexity-class of the general two- loop Wilson coefficients or hard scattering cross sections in massless QED and QCD and are described by six basic functions and their derivatives in Mellin space. The package Sigma, [151–154], proved to be a useful tool to solve the sums occurring in the present problem, leading to extensions of this code by the author. The main part of the thesis was the calculation of fixed moments of all 3–loop massive operator matrix elements AQg, Aqg,Q, APSQq, APSqq,Q, ANSqq,Q, Agq,Q, Agg,Q, cf. Section 7. These are needed to describe the asymptotic heavy flavor Wilson coefficients at O(a3s) and to derive massive quark–distributions at the same level, [129]. We developed computer algebra codes which allow based on QGRAF, [161], the automatic generation of 3–loop Feynman diagrams with local operator insertions. These were then projected onto massive tadpole diagrams for fixed values of the Mellin variable N . For the final calculation of the diagrams, use was made of the FORM–code MATAD, [164]. The representation of the massive OMEs is available for general values ofN in analytic form, apart from the constant terms a(3)ij of the unrenormalized 3–loop OMEs. This is achieved by combining our general expressions for the renormalized results, the all–N results up to O(a2sε) and results given in the literature. A number of fixed Mellin moments of the terms a(3)ij were calculated, reaching up to N = 10, 12, 14, depending on the complexity of the corresponding operator matrix element. The computation required about 250 CPU days on 32/64 Gb–machines. Through the renormalization of the massive OMEs, the corresponding moments of the complete 2-loop anomalous dimensions and the TF–terms of the 3–loop anomalous dimensions were obtained, as were the moments of the complete anomalous dimensions γ(2),PSqq and γ(2)qg , in which we agree with the literature. This provides a first independent check of the moments of the fermionic contributions to the 3–loop anomalous dimensions, which have been obtained in Refs. [111,112]. In Section 8, we presented results on the effects of heavy quarks in polarized deep– inelastic scattering, using essentially the same description as in the unpolarized case. We worked in the scheme for γ5 in dimensional regularization used in Ref. [165] and could confirm the results given there for the 2–loop massive OMEs ∆APSQq and ∆AQg. Addition- ally, we newly presented the O(ε) contributions of these terms. We calculated the 2–loop massive OMEs of transversity for all–N and the 3–loop terms for the moments N = 1, . . . , 13 in Section 9. This calculation is not yet of phenomenolog- ical use, since the corresponding light flavor Wilson coefficients have not been calculated so far. However, these results could be obtained by making only minor changes to the computer programs written for the unpolarized case. We confirmed for the first time the moments N = 1, . . . , 8 of the fermionic contributions to the 3–loop transversity anoma- lous dimension obtained in Refs. [360]. Our results can, however, be used in comparison with lattice calculations. Several steps were undertaken towards an all–N calculation of the massive OMEs. Four non–trivial 3–loop massive topologies contribute. We presented in an example a first all–N result for a ladder–topology in Section 10.1. In Section 10.2, we described a general algorithm to calculate the exact expression for single scale quantities from a finite (suitably large) number of moments, which are zero 133 scale quantities. The latter are much more easily calculable than single scale quantities. We applied the method to the anomalous dimensions and massless Wilson coefficients up to 3–loop order, [115, 124, 125]. Solving 3–loop problems in this way directly is not possible at present, since the number of required moments is too large for the methods available. Yet this method constitutes a proof of principle and may find application in medium–sized problems in the future. 134 A Conventions We use natural units ~ = 1 , c = 1 , ε0 = 1 , (A.1) where ~ denotes Planck’s constant, c the vacuum speed of light and ε0 the permittivity of vacuum. The electromagnetic fine–structure constant α is given by α = α′(µ2 = 0) = e 2 4πε0~c = e2 4π ≈ 1 137.03599911(46) . (A.2) In this convention, energies and momenta are given in the same units, electron volt (eV). The space–time dimension is taken to be D = 4 + ε and the metric tensor gµν in Minkowski–space is defined as g00 = 1 , gii = −1 , i = 1 . . . D − 1 , gij = 0 , i 6= j . (A.3) Einstein’s summation convention is used, i.e. xµyµ := D−1∑ µ=0 xµyµ . (A.4) Bold–faced symbols represent (D − 1)–dimensional spatial vectors: x = (x0,x) . (A.5) If not stated otherwise, Greek indices refer to the D–component space–time vector and Latin ones to the D−1 spatial components only. The dot product of two vectors is defined by p.q = p0q0 − D−1∑ i=1 piqi . (A.6) The γ–matrices γµ are taken to be of dimension D and fulfill the anti–commutation relation {γµ, γν} = 2gµν . (A.7) It follows that γµγµ = D (A.8) Tr (γµγν) = 4gµν (A.9) Tr (γµγνγαγβ) = 4[gµνgαβ + gµβgνα − gµαgνβ] . (A.10) The slash–symbol for a D-momentum p is defined by /p := γµpµ . (A.11) The conjugate of a bi–spinor u of a particle is given by u = u†γ0 , (A.12) 137 where † denotes Hermitian and ∗ complex conjugation, respectively. The bi–spinors u and v fulfill the free Dirac–equation, (/p−m)u(p) = 0 , u(p)(/p−m) = 0 (A.13) (/p+m)v(p) = 0 , v(p)(/p+m) = 0 . (A.14) Bi–spinors and polarization vectors are normalized to ∑ σ u(p, σ)u(p, σ) = /p+m (A.15) ∑ σ v(p, σ)v(p, σ) = /p−m (A.16) ∑ λ ǫµ(k, λ)ǫν(k, λ) = −gµν , (A.17) where λ and σ represent the spin. The commonly used caret “ˆ” to signify an operator, e.g. Oˆ, is omitted if confusion is not to be expected. The gauge symmetry group of QCD is the Lie–Group SU(3)c. We consider the general case of SU(Nc). The non–commutative generators are denoted by ta, where a runs from 1 to N2c − 1. The generators can be represented by Hermitian, traceless matrices, [38]. The structure constants fabc and dabc of SU(Nc) are defined via the commutation and anti–commutation relations of its generators, [190], [ta, tb] = ifabctc (A.18) {ta, tb} = dabctc + 1Nc δab . (A.19) The indices of the color matrices, in a certain representation, are denoted by i, j, k, l, ... The color invariants most commonly encountered are δabCA = facdf bcd (A.20) δijCF = tailtalj (A.21) δabTF = taiktbki . (A.22) These constants evaluate to CA = Nc , CF = N2c − 1 2Nc , TF = 1 2 . (A.23) At higher loops, more color–invariants emerge. At 3–loop order, one additionally obtains dabddabc = (N2c − 1)(N2c − 4)/Nc . (A.24) In case of SU(3)c, CA = 3 , CF = 4/3 , dabcdabc = 40/3 holds. 138 B Feynman Rules For the QCD Feynman rules, Figure 20, we follow Ref. [190], cf. also Refs. [374]. D– dimensional momenta are denoted by pi and Lorentz-indices by Greek letters. Color indices are a, b, ... and i, j are indices of the color matrices. Solid lines represent fermions, wavy lines gluons and dashed lines ghosts. Arrows denote the direction of the momenta. A factor (−1) has to be included for each closed fermion– or ghost loop. ji µ, a igsγµtaji ρ, c, p3 ↓ ν, b, p2 ↓ µ, a, p1 ↑ −gsfabc[(p1 − p2)ρgµν + (p2 − p3)µgνρ + (p3 − p1)νgµρ] c, pb µ, a −gsfabcpµ ρ, cν, b σ, dµ, a −ig2s ∑ e { fabef cde[gµρgνσ − gµσgνρ] +facef bde[gµνgρσ − gµσgνρ] +fadef cbe[gµρgνσ − gµνgρσ] } i p j i p/−m+i0δij a, µ p b, ν i p2+i0(−gµν + ξpµpν/(p2 + i0))δab a p b i p2+i0δab Figure 20: Feynman rules of QCD. 139 The Feynman rules for the quarkonic composite operators are given in Figure 21. Up to O(g2) they can be found in Ref. [119] and also in [341]. Note that the O(g) term in the former reference contains a typographical error. We have checked these terms and agree up to normalization factors, which may be due to other conventions being applied there. We newly derived the rule with three external gluons. The terms γ± refer to the unpolarized (+) and polarized (−) case, respectively. Gluon momenta are taken to be incoming. p, jp, i δij/∆γ±(∆ · p)N−1 , N ≥ 1 p2, jp1, i µ, a gtaji∆ µ/∆γ± ∑N−2 j=0 (∆ · p1)j(∆ · p2)N−j−2 , N ≥ 2 p2, jp1, i p3, µ, a p4, ν, b g2∆µ∆ν/∆γ± ∑N−3 j=0 ∑N−2 l=j+1(∆p2) j(∆p1)N−l−2[ (tatb)ji(∆p1 +∆p4)l−j−1 + (tbta)ji(∆p1 +∆p3)l−j−1 ] , N ≥ 3 p2, jp1, i p3, µ, a p4, ν, b p5, ρ, c g3∆µ∆ν∆ρ/∆γ± ∑N−4 j=0 ∑N−3 l=j+1 ∑N−2 m=l+1(∆.p2) j(∆.p1)N−m−2[ (tatbtc)ji(∆.p4 +∆.p5 +∆.p1)l−j−1(∆.p5 +∆.p1)m−l−1 +(tatctb)ji(∆.p4 +∆.p5 +∆.p1)l−j−1(∆.p4 +∆.p1)m−l−1 +(tbtatc)ji(∆.p3 +∆.p5 +∆.p1)l−j−1(∆.p5 +∆.p1)m−l−1 +(tbtcta)ji(∆.p3 +∆.p5 +∆.p1)l−j−1(∆.p3 +∆.p1)m−l−1 +(tctatb)ji(∆.p3 +∆.p4 +∆.p1)l−j−1(∆.p4 +∆.p1)m−l−1 +(tctbta)ji(∆.p3 +∆.p4 +∆.p1)l−j−1(∆.p3 +∆.p1)m−l−1 ] , N ≥ 4 γ+ = 1 , γ− = γ5 . For transversity, one has to replace: /∆γ± → σµν∆ν . Figure 21: Feynman rules for quarkonic composite operators. ∆ denotes a light-like 4-vector, ∆2 = 0; N is a suitably large positive integer. 140 The Feynman rules for the unpolarized gluonic composite operators are given in Figure 22. Up to O(g2), they can be found in Refs. [120] and [123]. We have checked these terms and agree up to O(g0). At O(g), we agree with [120], but not with [123]. At O(g2), we do not agree with either of these results, which even differ from each other36. p, µ, ap, ν, b 1+(−1)N 2 δ ab(∆ · p)N−2 [ gµν(∆ · p)2 − (∆µpν +∆νpµ)∆ · p + p2∆µ∆ν ] , N ≥ 2 p1, µ, a → p2, ν, b ↑ p3, λ, c ← −ig 1+(−1)N2 fabc ( [ (∆νgλµ −∆λgµν)∆ · p1 +∆µ(p1,ν∆λ − p1,λ∆ν) ] (∆ · p1)N−2 +∆λ [ ∆ · p1p2,µ∆ν +∆ · p2p1,ν∆µ −∆ · p1∆ · p2gµν − p1 · p2∆µ∆ν ] × ∑N−3 j=0 (−∆ · p1)j(∆ · p2)N−3−j + { p1→p2→p3→p1 µ→ν→λ→µ } + { p1→p3→p2→p1 µ→λ→ν→µ }) , N ≥ 2 p1, µ, a → p2, ν, b ↑ p3, λ, c ↑ p4, σ, d ← g2 1+(−1) N 2 ( fabef cdeOµνλσ(p1, p2, p3, p4) +facef bdeOµλνσ(p1, p3, p2, p4) + fadef bceOµσνλ(p1, p4, p2, p3) ) , Oµνλσ(p1, p2, p3, p4) = ∆ν∆λ { −gµσ(∆ · p3 +∆ · p4)N−2 +[p4,µ∆σ −∆ · p4gµσ] ∑N−3 i=0 (∆ · p3 +∆ · p4)i(∆ · p4)N−3−i −[p1,σ∆µ −∆ · p1gµσ] ∑N−3 i=0 (−∆ · p1)i(∆ · p3 +∆ · p4)N−3−i +[∆ · p1∆ · p4gµσ + p1 · p4∆µ∆σ −∆ · p4p1,σ∆µ −∆ · p1p4,µ∆σ] ×∑N−4i=0 ∑i j=0(−∆ · p1)N−4−i(∆ · p3 +∆ · p4)i−j(∆ · p4)j } − { p1↔p2 µ↔ν } − { p3↔p4 λ↔σ } + { p1↔p2, p3↔p4 µ↔ν, λ↔σ } , N ≥ 2 Figure 22: Feynman rules for gluonic composite operators. ∆ denotes a light-like 4-vector, ∆2 = 0; N is an integer. 36We would like to thank J. Smith for the possibility to compare with their FORM–code used in Refs. [126,165,269,375], to which we agree. 141 C Special Functions In the following we summarize for convenience some relations for special functions which occur repeatedly in quantum field theory and are used in this thesis. C.1 The Γ–function The Γ-function, cf. [376,377], is analytic in the whole complex plane except at single poles at the non-positive integers. Its inverse is given by Euler’s infinite product 1 Γ(z) = z exp(γEz) ∞∏ i=1 [( 1 + z i ) exp(−z/i) ] . (C.1) The residues of the Γ-function at its poles are given by Res[Γ(z)]z=−N = (−1)N N ! , N ∈ N ∪ 0 . (C.2) In case of Re(z) > 0, it can be expressed by Euler’s integral Γ(z) = ∫ ∞ 0 exp(−t)tz−1dt , (C.3) from which one infers the well known functional equation of the Γ-function Γ(z + 1) = zΓ(z) , (C.4) which is used for analytic continuation. Around z = 1, the following series expansion is obtained Γ(1− ε) = exp(εγE) exp { ∞∑ i=2 ζi εi i } , (C.5) |ε| < 1 . (C.6) Here and in (C.1), γE denotes the Euler-Mascheroni constant, see Eq. (4.7). In (C.5) Riemann’s ζ–function is given by ζk = ∞∑ i=1 1 ik , 2 ≤ k ∈ N . (C.7) A shorthand notation for rational functions of Γ–functions is Γ [ a1, ..., ai b1, ..., bj ] := Γ(a1)...Γ(ai) Γ(b1)...Γ(bj) . (C.8) Functions closely related to the Γ-function are the function ψ(x), the Beta-function B(A,C) and the function β(x). The Beta-function can be defined by Eq. (C.8) B(A,C) = Γ [ A,C A+ C ] . (C.9) 142 If Re(A),Re(C) > 0, the following integral representation is valid B(A,C) = ∫ 1 0 dx xA−1(1− x)C−1 . (C.10) For arbitrary values of A and C, (C.10) can be continued analytically using Eqs. (C.1, C.9). Its expansion around singularities can be performed via Eqs. (C.2, C.5). The ψ-function and β(x) are defined as derivatives of the Γ-function via ψ(x) = 1 Γ(x) d dxΓ(x) . (C.11) β(x) = 1 2 [ ψ (x+ 1 2 ) − ψ (x 2 )] . (C.12) C.2 The Generalized Hypergeometric Function The generalized hypergeometric function PFQ is defined by, cf. [285,286], PFQ [ a1, ..., aP b1, ..., bQ ; z ] = ∞∑ i=0 (a1)i...(aP )i (b1)i...(bQ)i zi Γ(i+ 1) . (C.13) Here (c)n is Pochhammer’s symbol (c)n = Γ(c+ n) Γ(c) , (C.14) for which the following relation holds (N + 1)−i = (−1)i (−N)i , N ∈ N . (C.15) In (C.13), there are P numerator parameters a1...aP , Q denominator parameters b1...bQ and one variable z, all of which may be real or complex. Additionally, the denominator parameters must not be negative integers, since in that case (C.13) is not defined. The generalized hypergeometric series PFQ are evaluated at a certain value of z, which in this thesis is always z = 1 for the final integrals. Gauss was the first to study this kind of functions, introducing the Gauss function 2F1, and proved the theorem, cf. [285], 2F1[a, b; c; 1] = Γ [ c, c− a− b c− a, c− b ] , Re(c− a− b) > 0 (C.16) which is called Gauss’ theorem. An integral representation for the Gauss function is given by the integral, cf. [285], 2F1 [ a, b+ 1 c+ b+ 2; z ] = Γ [ c+ b+ 2 c+ 1, b+ 1 ]∫ 1 0 dx xb(1− x)c(1− zx)−a , (C.17) provided that the conditions |z| < 1 , Re(c+ 1), Re(b+ 1) > 0 , (C.18) 143 are obeyed. Applying Eq. (C.17) recursively, one obtains the following integral represen- tation for a general P+1FP–function P+1FP [ a0, a1, . . . , aP b1, . . . , bP ; z ] = Γ [ b1, . . . , bP a1, . . . , aP , b1 − a1, . . . , bP − aP ] × ∫ 1 0 dx1 . . . ∫ 1 0 dxPxa1−11 (1− x1)b1−a1−1 . . . xaP−1P (1− xP )bP−aP−1(1− zx1 . . . xP )−a0 , (C.19) under similar conditions as in Eq. (C.18). C.3 Mellin–Barnes Integrals For the Gauss function, there exists a representation in terms of a complex contour integral over Γ-functions. It is given by, cf. [285], 2F1 [ a, b c ; z ] = Γ(c) 2πiΓ(a)Γ(b) ∫ i∞+α −i∞+α Γ(a+ s)Γ(b+ s)Γ(−s) Γ(c+ s) (−z) sds , (C.20) under the conditions |z| < 1 , | arg(−z)| < π . (C.21) (C.20) only holds if one chooses the integration contour in the complex plane and the positive constant α in such a way that the poles of the Γ-functions containing (+s) are separated from those arising from the Γ-functions containing (−s) and closes the contour to the right. Setting b = 1, c = 1 in (C.20) one obtains 1F0[a; z] = 1 (1− z)a , (C.22) which yields the Mellin-Barnes transformation, cf. [305,307,378], 1 (X + Y )λ = 1 2πiΓ(λ) ∫ +i∞+α −i∞+α dsΓ(λ+ s)Γ(−s) Y s Xλ+s . (C.23) The contour has to be chosen as in (C.20) and the conditions 0 < α < Re(λ) , | arg(Y/X)| < π have to be fulfilled. C.4 Harmonic Sums and Nielsen–Integrals Expanding the Γ–function in ε, its logarithmic derivatives, the ψ(k)-functions, emerge. In many applications of perturbative QCD and QED, harmonic sums occur, cf. [142, 143], which can be considered as generalization of the ψ-function and the β-function. These are defined by Sa1,... ,am(N) = N∑ n1=1 n1∑ n2=1 . . . nm−1∑ nm=1 (sign(a1))n1 n|a1|1 (sign(a2))n2 n|a2|2 . . . (sign(am)) nm n|am|m , N ∈ N, ∀ l al ∈ Z \ 0 , (C.24) S∅ = 1 . (C.25) 144 We adopt the convention Sa1,... ,am ≡ Sa1,... ,am(N) , (C.26) i.e. harmonic sums are taken at argument (N), if no argument is indicated. Related quantities are the Z–sums defined by Zm1,... ,mk(N) = ∑ N≥i1>i2...>ik>0 ∏k l=1[sign(ml)]il i|ml|l . (C.27) The depth d and the weight w of a harmonic sum are given by d := m , (C.28) w := m∑ i=1 |ai| . (C.29) Harmonic sums of depth d = 1 are referred to as single harmonic sums. The complete set of algebraic relations connecting harmonic sums to other harmonic sums of the same or lower weight is known [146], see also [143] for an implementation in FORM. Thus the number of independent harmonic sums can be reduced significantly, e.g., for w = 3 the 18 possible harmonic sums can be expressed algebraically in terms of 8 basic harmonic sums only. One introduces a product for the harmonic sums, the shuffle product ⊔⊔ , cf. [146]. For the product of a single and a general finite harmonic sum it is given by Sa1(N)⊔⊔Sb1,... ,bm(N) = Sa1,b1,... ,bm(N) + Sb1,a1,b2,... ,bm(N) + . . .+ Sb1,b2,... ,bm,a1(N) . (C.30) For sums Sa1,... ,an(N) and Sb1,... ,bm(N) of arbitrary depth, the shuffle product is then the sum of all harmonic sums of depth m+ n in the index set of which ai occurs left of aj for i < j, likewise for bk and bl for k < l. Note that the shuffle product is symmetric. One can show that the following relation holds, cf. [146], Sa1(N) · Sb1,... ,bm(N) = Sa1(N)⊔⊔Sb1,... ,bm(N) −Sa1∧b1,b2,... ,bm(N)− . . .− Sb1,b2,... ,a1∧bm(N) , (C.31) where the ∧ symbol is defined as a ∧ b = sign(a)sign(b) (|a|+ |b|) . (C.32) Due to the additional terms containing wedges (∧) between indices, harmonic sums form a quasi–shuffle algebra, [304]. By summing (C.31) over permutations, one obtains the symmetric algebraic relations between harmonic sums. At depth 2 and 3 these read, [142], Sm,n + Sn,m = SmSn + Sm∧n , (C.33)∑ perm{l,m,n} Sl,m,n = SlSmSn + ∑ inv perm{l,m,n} SlSm∧n + 2 Sl∧m∧n , (C.34) which we used extensively to simplify our expressions. In (C.33, C.34), “perm” denotes all permutations and “inv perm” invariant ones. 145 The limit N →∞ of finite harmonic sums exists only if a1 6= 1 in (C.24). Additionally, one defines all σ-values symbolically as σkl,... ,k1 = limN→∞Sa1,... ,al(N) . (C.35) The finite σ-values are related to multiple ζ-values, [142, 143, 155, 379, 380], Eq. (C.7). Further we define the symbol σ0 := ∞∑ i=1 1 . (C.36) It is useful to include these σ-values into the algebra, since they allow to treat parts of sums individually, accounting for the respective divergences, cf. also [143]. These divergent pieces cancel in the end if the overall sum is finite. The relation of single harmonic sums with positive or negative indices to the ψ(k)– functions is then given by S1(N) = ψ(N + 1) + γE , (C.37) Sa(N) = (−1)a−1 Γ(a) ψ (a−1)(N + 1) + ζa , k ≥ 2 , (C.38) S−1(N) = (−1)Nβ(N + 1)− ln(2) , (C.39) S−a(N) = − (−1)N+a Γ(a) β (a−1)(N + 1)− ( 1− 21−a ) ζa , k ≥ 2 . (C.40) Thus single harmonic sums can be analytically continued to complex values of N by these relations. At higher depths, harmonic sums can be expressed in terms of Mellin– transforms of polylogarithms and the more general Nielsen-integrals, [291, 381,382]. The latter are defined by Sn,p(z) = (−1)n+p−1 (n− 1)!p! ∫ 1 0 dx x log n−1(x) logp(1− zx) (C.41) and fulfill the relation dSn,p(x) d log(x) = Sn−1,p(x) . (C.42) If p = 1, one obtains the polylogarithms Lin(x) = Sn−1,1(x) , (C.43) where Li0(x) = x 1− x . (C.44) These functions do not suffice for arbitrary harmonic sums, in which case the harmonic polylogarithms have to be considered, [314]. The latter functions obey a direct shuffle algebra, cf. [146, 155]. The representation in terms of Mellin–transforms then allows an analytic continuation of arbitrary harmonic sums to complex N , cf. [210, 211]. Equiva- lently, one may express harmonic sums by factorial series, [377, 383], up to polynomials of S1(N) and harmonic sums of lower degree, and use this representation for the analytic continuation to N ∈ C, cf. [121,147]. 146 D Finite and Infinite Sums In this appendix, we list some examples for infinite sums which were needed in the present analysis and are newly calculated. The calculation was done using the Sigma–package as explained in Section 6.2. A complete set of sums contributing to the calculation of the 2–loop massive OMEs can be found in Appendix B of Refs. [128,137]. ∞∑ i=1 B(N − 2, i) (i+N)3 = (−1) N 4S1,−2 + 2S−3 + 2ζ2S1 + 2ζ3 − 6S−2 − 3ζ2 (N − 2)(N − 1)N + 1 (N − 2)(N − 1)N2 . (D.1) ∞∑ i=1 B(N − 2, i) (i+N)2 S1(i+N − 2) = (−1)N+1 (N − 2)(N − 1)N ( 8S1,−2 − 4S−3 − 4S1S−2 − 2ζ3 +2ζ2S1 − 10S−2 − 5ζ2 ) + N2 − 3N + 3 (N − 2)(N − 1)2N2S1 − N 3 − 5N + 3 (N − 2)(N − 1)3N3 . (D.2) ∞∑ i=1 B(N, i) i+N + 2S1(i)S1(N + i) = (−1)N N(N + 1)(N + 2) ( 4S−2,1 − 6S−3 − 4S−2S1 − 2ζ3 −2ζ2S1 − 2 ζ2 (N + 1) − 4 S−2 (N + 1) ) + −2S3 − S1S2 + ζ2S1 + 2ζ3 N + 2 + 2 + 7N + 7N2 + 5N3 +N4 N3(N + 1)3(N + 2) S1 +2 2 + 7N + 9N2 + 4N3 +N4 N4(N + 1)3(N + 2) . (D.3) ∞∑ i=1 S1(i+N)S21(i) i+N = σ41 4 − 3ζ 2 2 4 + ( 2 N − 2S1 ) ζ3 + (S1 N − S21 2 − S2 2 ) ζ2 + S31 N −S 4 1 4 + S21 ( − 1N2 − 3S2 2 ) − S2N2 − S22 4 − S2,1N +S1 ( 3 S2 N + S2,1 − 2S3 ) + 2 S3 N + S3,1 − S4 . (D.4) ∞∑ i=1 ( S1(i+N)− S1(i) )3 = −3 2 S21 − S31 − 1 2 S2 + 3NS2,1 −NS3 +Nζ3 . (D.5) 147 ∞∑ k=1 B(k + ε/2, N + 1) N + k = (−1) N [ 2S−2 + ζ2 ] + ε 2 (−1)N [ −ζ3 + ζ2S1 + 2S1,−2 − 2S−2,1 ] + ε2 4 (−1)N [ 2 5 ζ22 − ζ3S1 + ζ2S1,1 +2 { S1,1,−2 + S−2,1,1 − S1,−2,1 }] + ε3(−1)N [ −ζ5 8 + S1 20 ζ22 − S1,1 8 ζ3 + S1,1,1 8 ζ2 + S1,−2,1,1 + S1,1,1,−2 − S−2,1,1,1 − S1,1,−2,1 4 ] +O(ε4) . (D.6) An example for a double infinite sum we encountered is given by N ∞∑ i,j=1 S1(i)S1(i+ j +N) i(i+ j)(j +N) = 4S2,1,1 − 2S3,1 + S1 ( −3S2,1 + 4S3 3 ) − S4 2 −S22 + S21S2 + S41 6 + 6S1ζ3 + ζ2 ( 2S21 + S2 ) . (D.7) A detailed description of the method to calculate this sum can be found in Appendix B of Ref. [137]. 148 E Moments of the Fermionic Contributions to the 3–Loop Anomalous Dimensions The pole terms of the unrenormalized OMEs in our calculation agree with the general structure we presented in Eqs. (4.94, 4.103, 4.104, 4.116, 4.117, 4.124, 4.134). Using the lower order renormalization coefficients and the constant terms of the 2–loop results, Eqs. (6.34, 6.53, 6.60, 6.68, 6.80), allows to determine the TF–terms of the 3–loop anomalous dimensions for fixed values of N . All our results agree with the results of Refs. [111,112, 124,125,317,318]. Note that in this way we obtain the complete expressions for the terms γ(2)qg and γ(2),PSqq , since they always involve an overall factor TF . For them we obtain (i) γˆ(2)qg : γˆ(2)qg (2) = TF [ (1 + 2nf )TF (8464 243 CA − 1384 243 CF ) + ζ3 3 ( −416CACF + 288C2A +128C2F ) − 7178 81 C2A + 556 9 CACF − 8620 243 C2F ] , (E.1) γˆ(2)qg (4) = TF [ (1 + 2nf )TF (4481539 303750 CA + 9613841 3037500 CF ) + ζ3 25 ( 2832C2A − 3876CACF +1044C2F ) − 295110931 3037500 C2A + 278546497 2025000 CACF − 757117001 12150000 C2F ] , (E.2) γˆ(2)qg (6) = TF [ (1 + 2nf )TF (86617163 11668860 CA + 1539874183 340341750 CF ) + ζ3 735 ( 69864C2A −94664CACF + 24800C2F ) − 58595443051 653456160 C2A + 1199181909343 8168202000 CACF −2933980223981 40841010000 C2F ] , (E.3) γˆ(2)qg (8) = TF [ (1 + 2nf )TF (10379424541 2755620000 CA + 7903297846481 1620304560000 CF ) +ζ3 (128042 1575 C2A − 515201 4725 CACF + 749 27 C2F ) − 24648658224523 289340100000 C2A + 4896295442015177 32406091200000 CACF − 4374484944665803 56710659600000 C2F ] , (E.4) γˆ(2)qg (10) = TF [ (1 + 2nf )TF (1669885489 988267500 CA + 1584713325754369 323600780868750 CF ) +ζ3 (1935952 27225 C2A − 2573584 27225 CACF + 70848 3025 C2F ) − 21025430857658971 255684567600000 C2A 149 + 926990216580622991 6040547909550000 CACF − 1091980048536213833 13591232796487500 C2F ] . (E.5) (ii) γˆ(2),PSqq : γˆ(2),PSqq (2) = TFCF [ −(1 + 2nf )TF 5024 243 + 256 3 ( CF − CA ) ζ3 + 10136 243 CA −14728 243 CF ] , (E.6) γˆ(2),PSqq (4) = TFCF [ −(1 + 2nf )TF 618673 151875 + 968 75 ( CF − CA ) ζ3 + 2485097 506250 CA −2217031 675000 CF ] , (E.7) γˆ(2),PSqq (6) = TFCF [ −(1 + 2nf )TF 126223052 72930375 + 3872 735 ( CF − CA ) ζ3 + 1988624681 4084101000 CA + 11602048711 10210252500 CF ] , (E.8) γˆ(2),PSqq (8) = TFCF [ −(1 + 2nf )TF 13131081443 13502538000 + 2738 945 ( CF − CA ) ζ3 −343248329803 648121824000 CA + 39929737384469 22684263840000 CF ] , (E.9) γˆ(2),PSqq (10) = TFCF [ −(1 + 2nf )TF 265847305072 420260754375 + 50176 27225 ( CF − CA ) ζ3 −1028766412107043 1294403123475000 CA + 839864254987192 485401171303125 CF ] , (E.10) γˆ(2),PSqq (12) = TFCF [ −(1 + 2nf )TF 2566080055386457 5703275664286200 + 49928 39039 ( CF − CA ) ζ3 −69697489543846494691 83039693672007072000 CA + 86033255402443256197 54806197823524667520 CF ] . (E.11) For the remaining terms, only the projection onto the color factor TF can be obtained : (iii) γˆ(2),NS,+qq : γˆ(2),NS,+qq (2) = TFCF [ −(1 + 2nf )TF 1792 243 + 256 3 ( CF − CA ) ζ3 − 12512 243 CA 150 −13648 243 CF ] , (E.12) γˆ(2),NS,+qq (4) = TFCF [ −(1 + 2nf )TF 384277 30375 + 2512 15 ( CF − CA ) ζ3 −8802581 121500 CA − 165237563 1215000 CF ] , (E.13) γˆ(2),NS,+qq (6) = TFCF [ −(1 + 2nf )TF 160695142 10418625 + 22688 105 ( CF − CA ) ζ3 −13978373 171500 CA − 44644018231 243101250 CF ] , (E.14) γˆ(2),NS,+qq (8) = TFCF [ −(1 + 2nf )TF 38920977797 2250423000 + 79064 315 ( CF − CA ) ζ3 −1578915745223 18003384000 CA − 91675209372043 420078960000 CF ] , (E.15) γˆ(2),NS,+qq (10) = TFCF [ −(1 + 2nf )TF 27995901056887 1497656506500 + 192880 693 ( CF − CA ) ζ3 −9007773127403 97250422500 CA − 75522073210471127 307518802668000 CF ] , (E.16) γˆ(2),NS,+qq (12) = TFCF [ −(1 + 2nf )TF 65155853387858071 3290351344780500 + 13549568 45045 ( CF − CA ) ζ3 −25478252190337435009 263228107582440000 CA − 35346062280941906036867 131745667845011220000 CF ] , (E.17) γˆ(2),NS,+qq (14) = TFCF [ −(1 + 2nf )TF 68167166257767019 3290351344780500 + 2881936 9009 ( CF − CA ) ζ3 −92531316363319241549 921298376538540000 CA − 37908544797975614512733 131745667845011220000 CF ] . (E.18) (iv) γˆ(2),NS,−qq : γˆ(2),NS,−qq (1) = 0 , (E.19) γˆ(2),NS,−qq (3) = TFCF [ −(1 + 2nf )TF 2569 243 + 400 3 ( CF − CA ) ζ3 − 62249 972 CA 151 −203627 1944 CF ] , (E.20) γˆ(2),NS,−qq (5) = TFCF [ −(1 + 2nf )TF 431242 30375 + 2912 15 ( CF − CA ) ζ3 −38587 500 CA − 5494973 33750 CF ] , (E.21) γˆ(2),NS,−qq (7) = TFCF [ −(1 + 2nf )TF 1369936511 83349000 + 8216 35 ( CF − CA ) ζ3 −2257057261 26671680 CA − 3150205788689 15558480000 CF ] , (E.22) γˆ(2),NS,−qq (9) = TFCF [ −(1 + 2nf )TF 20297329837 1125211500 + 16720 63 ( CF − CA ) ζ3 −126810403414 1406514375 CA − 1630263834317 7001316000 CF ] , (E.23) γˆ(2),NS,−qq (11) = TFCF [ −(1 + 2nf )TF 28869611542843 1497656506500 + 1005056 3465 ( CF − CA ) ζ3 −1031510572686647 10892047320000 CA − 1188145134622636787 4612782040020000 CF ] , (E.24) γˆ(2),NS,−qq (13) = TFCF [ −(1 + 2nf )TF 66727681292862571 3290351344780500 + 13995728 45045 ( CF − CA ) ζ3 −90849626920977361109 921298376538540000 CA − 36688336888519925613757 131745667845011220000 CF ] . (E.25) (v) γˆ(2)gg : γˆ(2)gg (2) = TF [ (1 + 2nf )TF ( −8464 243 CA + 1384 243 CF ) + ζ3 3 ( −288C2A + 416CACF −128C2F ) + 7178 81 C2A − 556 9 CACF + 8620 243 C2F ] , (E.26) γˆ(2)gg (4) = TF [ (1 + 2nf )TF ( −757861 30375 CA − 979774 151875 CF ) + ζ3 25 ( −6264C2A + 6528CACF 152 −264C2F ) + 53797499 607500 C2A − 235535117 1012500 CACF + 2557151 759375 C2F ] , (E.27) γˆ(2)gg (6) = TF [ (1 + 2nf )TF ( −52781896 2083725 CA − 560828662 72930375 CF ) + ζ3 ( −75168 245 C2A + 229024 735 CACF − 704 147 C2F ) + 9763460989 116688600 C2A − 9691228129 32672808 CACF −11024749151 10210252500 C2F ] , (E.28) γˆ(2)gg (8) = TF [ (1 + 2nf )TF ( −420970849 16074450 CA − 6990254812 843908625 CF ) +ζ3 ( −325174 945 C2A + 327764 945 CACF − 74 27 C2F ) + 2080130771161 25719120000 C2A −220111823810087 648121824000 CACF − 14058417959723 5671065960000 C2F ] , (E.29) γˆ(2)gg (10) = TF [ (1 + 2nf )TF ( −2752314359 101881395 CA − 3631303571944 420260754375 CF ) +ζ3 ( −70985968 190575 C2A + 71324656 190575 CACF − 5376 3025 C2F ) + 43228502203851731 549140719050000 C2A − 3374081335517123191 9060821864325000 CFCA −3009386129483453 970802342606250 C2F ] . (E.30) (vi) γˆ(2)gq : γˆ(2)gq (2) = TFCF [ (1 + 2nf )TF 2272 81 + 512 3 ( CA − CF ) ζ3 + 88 9 CA + 28376 243 CF ] , (E.31) γˆ(2)gq (4) = TFCF [ (1 + 2nf )TF 109462 10125 + 704 15 ( CA − CF ) ζ3 − 799 12150 CA + 14606684 759375 CF ] , (E.32) γˆ(2)gq (6) = TFCF [ (1 + 2nf )TF 22667672 3472875 + 2816 105 ( CA − CF ) ζ3 − 253841107 145860750 CA 153 + 20157323311 2552563125 CF ] , (E.33) γˆ(2)gq (8) = TFCF [ (1 + 2nf )TF 339184373 75014100 + 1184 63 ( CA − CF ) ζ3 −3105820553 1687817250 CA + 8498139408671 2268426384000 CF ] , (E.34) γˆ(2)gq (10) = TFCF [ (1 + 2nf )TF 1218139408 363862125 + 7168 495 ( CA − CF ) ζ3 −18846629176433 11767301122500 CA + 529979902254031 323600780868750 CF ] , (E.35) γˆ(2)gq (12) = TFCF [ (1 + 2nf )TF 13454024393417 5222779912350 + 5056 429 ( CA − CF ) ζ3 −64190493078139789 48885219979596000 CA + 1401404001326440151 3495293228541114000 CF ] , (E.36) γˆ(2)gq (14) = TFCF [ (1 + 2nf )TF 19285002274 9495963477 + 13568 1365 ( CA − CF ) ζ3 −37115284124613269 35434552943790000 CA − 40163401444446690479 104797690331258925000 CF ] . (E.37) 154 F The O(ε0) Contributions to ˆˆA (3) ij Finally, we present all moments we calculated. We only give the constant term in ε of the unrenormalized result, cf. Eqs. (4.94, 4.103, 4.104, 4.116, 4.117, 4.124, 4.134). These terms have to be inserted into the general results on the renormalized level, cf. Eqs. (4.96, 4.105, 4.106, 4.118, 4.119, 4.126, 4.137). We obtain (i) a(3),PSQq : a(3),PSQq (2) = TFCFCA ( 117290 2187 + 64 9 B4 − 64ζ4 + 1456 27 ζ3 + 224 81 ζ2 ) +TFC2F ( 42458 243 − 128 9 B4 + 64ζ4 − 9664 81 ζ3 + 704 27 ζ2 ) +T 2FCF ( −36880 2187 − 4096 81 ζ3 − 736 81 ζ2 ) +nfT 2FCF ( −76408 2187 + 896 81 ζ3 − 112 81 ζ2 ) , (F.1) a(3),PSQq (4) = TFCFCA ( 23115644813 1458000000 + 242 225 B4 − 242 25 ζ4 + 1403 180 ζ3 + 283481 270000 ζ2 ) +TFC2F ( −181635821459 8748000000 − 484 225 B4 + 242 25 ζ4 + 577729 40500 ζ3 + 4587077 1620000 ζ2 ) + T 2FCF ( −2879939 5467500 − 15488 2025 ζ3 − 1118 2025 ζ2 ) +nfT 2FCF ( −474827503 109350000 + 3388 2025 ζ3 − 851 20250 ζ2 ) , (F.2) a(3),PSQq (6) = TFCFCA ( 111932846538053 10291934520000 + 968 2205 B4 − 968 245 ζ4 + 2451517 1852200 ζ3 + 5638039 7779240 ζ2 ) + TFC2F ( −238736626635539 5145967260000 − 1936 2205 B4 + 968 245 ζ4 + 19628197 555660 ζ3 + 8325229 10804500 ζ2 ) + T 2FCF ( 146092097 1093955625 − 61952 19845 ζ3 − 7592 99225 ζ2 ) + nfT 2FCF ( −82616977 45378900 + 1936 2835 ζ3 − 16778 694575 ζ2 ) , (F.3) a(3),PSQq (8) = TFCFCA ( 314805694173451777 32665339929600000 + 1369 5670 B4 − 1369 630 ζ4 155 −202221853 137168640 ζ3 + 1888099001 3429216000 ζ2 ) + TFC2F ( −25652839216168097959 457314759014400000 −1369 2835 B4 + 1369 630 ζ4 + 2154827491 48988800 ζ3 + 12144008761 48009024000 ζ2 ) +T 2FCF ( 48402207241 272211166080 − 43808 25515 ζ3 + 1229 142884 ζ2 ) +nfT 2FCF ( −16194572439593 15122842560000 + 1369 3645 ζ3 − 343781 14288400 ζ2 ) , (F.4) a(3),PSQq (10) = TFCFCA ( 989015303211567766373 107642563748181000000 + 12544 81675 B4 − 12544 9075 ζ4 −1305489421 431244000 ζ3 + 2903694979 6670805625 ζ2 ) + TFC2F ( −4936013830140976263563 80731922811135750000 −25088 81675 B4 + 12544 9075 ζ4 + 94499430133 1940598000 ζ3 + 282148432 4002483375 ζ2 ) +T 2FCF ( 430570223624411 2780024890190625 − 802816 735075 ζ3 + 319072 11026125 ζ2 ) +nfT 2FCF ( −454721266324013 624087220246875 + 175616 735075 ζ3 − 547424 24257475 ζ2 ) , (F.5) a(3),PSQq (12) = TFCFCA ( 968307050156826905398206547 107727062441920086477312000 + 12482 117117 B4 − 12482 13013 ζ4 −64839185833913 16206444334080 ζ3 + 489403711559293 1382612282251200 ζ2 ) +TFC2F ( −190211298439834685159055148289 2962494217152802378126080000 − 24964 117117 B4 + 12482 13013 ζ4 + 418408135384633 8103222167040 ζ3 − 72904483229177 15208735104763200 ζ2 ) +T 2FCF ( 1727596215111011341 13550982978344011200 − 798848 1054053 ζ3 + 11471393 347837490 ζ2 ) +nfT 2FCF ( − 6621557709293056160177 12331394510293050192000 + 24964 150579 ζ3 − 1291174013 63306423180 ζ2 ) . (F.6) 156 (ii) a(3),PSqq,Q : a(3),PSqq,Q (2) = nfT 2FCF ( −100096 2187 + 896 81 ζ3 − 256 81 ζ2 ) , (F.7) a(3),PSqq,Q (4) = nfT 2FCF ( −118992563 21870000 + 3388 2025 ζ3 − 4739 20250 ζ2 ) , (F.8) a(3),PSqq,Q (6) = nfT 2FCF ( −17732294117 10210252500 + 1936 2835 ζ3 − 9794 694575 ζ2 ) , (F.9) a(3),PSqq,Q (8) = nfT 2FCF ( −20110404913057 27221116608000 + 1369 3645 ζ3 + 135077 4762800 ζ2 ) , (F.10) a(3),PSqq,Q (10) = nfT 2FCF ( −308802524517334 873722108345625 + 175616 735075 ζ3 + 4492016 121287375 ζ2 ) , (F.11) a(3),PSqq,Q (12) = nfT 2FCF ( − 6724380801633998071 38535607844665781850 + 24964 150579 ζ3 + 583767694 15826605795 ζ2 ) , (F.12) a(3),PSqq,Q (14) = nfT 2FCF ( − 616164615443256347333 7545433703850642600000 + 22472 184275 ζ3 + 189601441 5533778250 ζ2 ) . (F.13) (iii) a(3)Qg : a(3)Qg(2) = TFC2A ( 170227 4374 − 88 9 B4 + 72ζ4 − 31367 324 ζ3 + 1076 81 ζ2 ) +TFCFCA ( −154643 729 + 208 9 B4 − 104ζ4 + 7166 27 ζ3 − 54ζ2 ) +TFC2F ( −15574 243 − 64 9 B4 + 32ζ4 − 3421 81 ζ3 + 704 27 ζ2 ) + T 2FCA ( −20542 2187 + 4837 162 ζ3 − 670 81 ζ2 ) + T 2FCF ( 11696 729 + 569 81 ζ3 + 256 9 ζ2 ) − 64 27 T 3F ζ3 +nfT 2FCA ( −6706 2187 − 616 81 ζ3 − 250 81 ζ2 ) + nfT 2FCF ( 158 243 + 896 81 ζ3 + 40 9 ζ2 ) , (F.14) 157 a(3)Qg(4) = TFC2A ( −425013969083 2916000000 − 559 50 B4 + 2124 25 ζ4 − 352717109 5184000 ζ3 −4403923 270000 ζ2 ) + TFCFCA ( −95898493099 874800000 + 646 25 B4 − 2907 25 ζ4 + 172472027 864000 ζ3 − 923197 40500 ζ2 ) + TFC2F ( −87901205453 699840000 − 174 25 B4 + 783 25 ζ4 + 937829 12960 ζ3 + 62019319 3240000 ζ2 ) + T 2FCA ( 960227179 29160000 + 1873781 51840 ζ3 + 120721 13500 ζ2 ) + T 2FCF ( −1337115617 874800000 + 73861 324000 ζ3 + 8879111 810000 ζ2 ) −176 135 T 3F ζ3 + nfT 2FCA ( 947836283 72900000 − 18172 2025 ζ3 − 11369 13500 ζ2 ) +nfT 2FCF ( 8164734347 4374000000 + 130207 20250 ζ3 + 1694939 810000 ζ2 ) , (F.15) a(3)Qg(6) = TFC2A ( −48989733311629681 263473523712000 − 2938 315 B4 + 17466 245 ζ4 − 748603616077 11379916800 ζ3 −93013721 3457440 ζ2 ) + TFCFCA ( 712876107019 55319040000 + 47332 2205 B4 − 23666 245 ζ4 + 276158927731 1896652800 ζ3 + 4846249 11113200 ζ2 ) + TFC2F ( −38739867811364113 137225793600000 −2480 441 B4 + 1240 49 ζ4 + 148514798653 711244800 ζ3 + 4298936309 388962000 ζ2 ) +T 2FCA ( 706058069789557 18819537408000 + 3393002903 116121600 ζ3 + 6117389 555660 ζ2 ) +T 2FCF ( −447496496568703 54890317440000 − 666922481 284497920 ζ3 + 49571129 9724050 ζ2 ) −176 189 T 3F ζ3 + nfT 2FCA ( 12648331693 735138180 − 4433 567 ζ3 + 23311 111132 ζ2 ) +nfT 2FCF ( −8963002169173 1715322420000 + 111848 19845 ζ3 + 11873563 19448100 ζ2 ) , (F.16) a(3)Qg(8) = TFC2A ( −358497428780844484961 2389236291993600000 − 899327 113400 B4 + 64021 1050 ζ4 158 −12321174818444641 112368549888000 ζ3 − 19581298057 612360000 ζ2 ) +TFCFCA ( 941315502886297276939 8362327021977600000 + 515201 28350 B4 − 515201 6300 ζ4 + 5580970944338269 56184274944000 ζ3 + 495290785657 34292160000 ζ2 ) +TFC2F ( −23928053971795796451443 36585180721152000000 − 749 162 B4 + 749 36 ζ4 + 719875828314061 1404606873600 ζ3 + 2484799653079 480090240000 ζ2 ) + T 2FCA ( 156313300657148129 4147979673600000 + 58802880439 2388787200 ζ3 + 46224083 4082400 ζ2 ) + T 2FCF ( −986505627362913047 87107573145600000 −185046016777 50164531200 ζ3 + 7527074663 3429216000 ζ2 ) − 296 405 T 3F ζ3 +nfT 2FCA ( 24718362393463 1322697600000 − 125356 18225 ζ3 + 2118187 2916000 ζ2 ) +nfT 2FCF ( −291376419801571603 32665339929600000 + 887741 174960 ζ3 − 139731073 1143072000 ζ2 ) , (F.17) a(3)Qg(10) = TFC2A ( 6830363463566924692253659 685850575063965696000000 − 563692 81675 B4 + 483988 9075 ζ4 − 103652031822049723 415451499724800 ζ3 − 20114890664357 581101290000 ζ2 ) +TFCFCA ( 872201479486471797889957487 2992802509370032128000000 + 1286792 81675 B4 −643396 9075 ζ4 − 761897167477437907 33236119977984000 ζ3 + 15455008277 660342375 ζ2 ) +TFC2F ( −247930147349635960148869654541 148143724213816590336000000 − 11808 3025 B4 + 53136 3025 ζ4 + 9636017147214304991 7122025709568000 ζ3 + 14699237127551 15689734830000 ζ2 ) 159 +T 2FCA ( 23231189758106199645229 633397356480430080000 + 123553074914173 5755172290560 ζ3 + 4206955789 377338500 ζ2 ) +T 2FCF ( −18319931182630444611912149 1410892611560158003200000 − 502987059528463 113048027136000 ζ3 + 24683221051 46695639375 ζ2 ) − 896 1485 T 3F ζ3 + nfT 2FCA ( 297277185134077151 15532837481700000 −1505896 245025 ζ3 + 189965849 188669250 ζ2 ) + nfT 2FCF ( −1178560772273339822317 107642563748181000000 + 62292104 13476375 ζ3 − 49652772817 93391278750 ζ2 ) . (F.18) (iv) a(3)qg,Q : a(3)qg,Q(2) = nfT 2FCA ( 83204 2187 − 616 81 ζ3 + 290 81 ζ2 ) +nfT 2FCF ( −5000 243 + 896 81 ζ3 − 4 3 ζ2 ) , (F.19) a(3)qg,Q(4) = nfT 2FCA ( 835586311 14580000 − 18172 2025 ζ3 + 71899 13500 ζ2 ) +nfT 2FCF ( −21270478523 874800000 + 130207 20250 ζ3 − 1401259 810000 ζ2 ) , (F.20) a(3)qg,Q(6) = nfT 2FCA ( 277835781053 5881105440 − 4433 567 ζ3 + 2368823 555660 ζ2 ) +nfT 2FCF ( −36123762156197 1715322420000 + 111848 19845 ζ3 − 26095211 19448100 ζ2 ) , (F.21) a(3)qg,Q(8) = nfT 2FCA ( 157327027056457 3968092800000 − 125356 18225 ζ3 + 7917377 2268000 ζ2 ) +nfT 2FCF ( −201046808090490443 10888446643200000 + 887741 174960 ζ3 −3712611349 3429216000 ζ2 ) , (F.22) a(3)qg,Q(10) = nfT 2FCA ( 6542127929072987 191763425700000 − 1505896 245025 ζ3 + 1109186999 377338500 ζ2 ) 160 +nfT 2FCF ( −353813854966442889041 21528512749636200000 + 62292104 13476375 ζ3 − 83961181063 93391278750 ζ2 ) . (F.23) (v) a(3)gq,Q : a(3)gq,Q(2) = TFCFCA ( −126034 2187 − 128 9 B4 + 128ζ4 − 9176 81 ζ3 − 160 81 ζ2 ) +TFC2F ( −741578 2187 + 256 9 B4 − 128ζ4 + 17296 81 ζ3 − 4496 81 ζ2 ) +T 2FCF ( 21872 729 + 2048 27 ζ3 + 416 27 ζ2 ) + nfT 2FCF ( 92200 729 − 896 27 ζ3 + 208 27 ζ2 ) , (F.24) a(3)gq,Q(4) = TFCFCA ( −5501493631 218700000 − 176 45 B4 + 176 5 ζ4 − 8258 405 ζ3 + 13229 8100 ζ2 ) + TFC2F ( −12907539571 145800000 + 352 45 B4 − 176 5 ζ4 + 132232 2025 ζ3 − 398243 27000 ζ2 ) +T 2FCF ( 1914197 911250 + 2816 135 ζ3 + 1252 675 ζ2 ) +nfT 2FCF ( 50305997 1822500 − 1232 135 ζ3 + 626 675 ζ2 ) , (F.25) a(3)gq,Q(6) = TFCFCA ( −384762916141 24504606000 − 704 315 B4 + 704 35 ζ4 − 240092 19845 ζ3 + 403931 463050 ζ2 ) + TFC2F ( −40601579774533 918922725000 + 1408 315 B4 − 704 35 ζ4 + 27512264 694575 ζ3 − 24558841 3472875 ζ2 ) + T 2FCF ( −279734446 364651875 + 11264 945 ζ3 + 8816 33075 ζ2 ) + nfT 2FCF ( 4894696577 364651875 − 704 135 ζ3 161 + 4408 33075 ζ2 ) , (F.26) a(3)gq,Q(8) = TFCFCA ( −10318865954633473 816633498240000 − 296 189 B4 + 296 21 ζ4 − 1561762 178605 ζ3 + 30677543 85730400 ζ2 ) + TFC2F ( −305405135103422947 11432868975360000 + 592 189 B4 − 296 21 ζ4 + 124296743 4286520 ζ3 − 4826251837 1200225600 ζ2 ) + T 2FCF ( −864658160833 567106596000 + 4736 567 ζ3 − 12613 59535 ζ2 ) + nfT 2FCF ( 9330164983967 1134213192000 − 296 81 ζ3 − 12613 119070 ζ2 ) , (F.27) a(3)gq,Q(10) = TFCFCA ( −1453920909405842897 130475834846280000 − 1792 1485 B4 + 1792 165 ζ4 − 1016096 147015 ζ3 + 871711 26952750 ζ2 ) + TFC2F ( −11703382372448370173 667205973645750000 + 3584 1485 B4 −1792 165 ζ4 + 62282416 2695275 ζ3 − 6202346032 2547034875 ζ2 ) + T 2FCF ( −1346754066466 756469357875 + 28672 4455 ζ3 − 297472 735075 ζ2 ) + nfT 2FCF ( 4251185859247 756469357875 − 12544 4455 ζ3 −148736 735075 ζ2 ) , (F.28) a(3)gq,Q(12) = TFCFCA ( −1515875996003174876943331 147976734123516602304000 − 1264 1287 B4 + 1264 143 ζ4 −999900989 173918745 ζ3 − 693594486209 3798385390800 ζ2 ) +TFC2F ( −48679935129017185612582919 4069360188396706563360000 + 2528 1287 B4 − 1264 143 ζ4 + 43693776149 2260943685 ζ3 − 2486481253717 1671289571952 ζ2 ) +T 2FCF ( −2105210836073143063 1129248581528667600 + 20224 3861 ζ3 − 28514494 57972915 ζ2 ) +nfT 2FCF ( 9228836319135394697 2258497163057335200 − 8848 3861 ζ3 − 14257247 57972915 ζ2 ) , (F.29)162 a(3)gq,Q(14) = TFCFCA ( −1918253569538142572718209 199199449781656964640000 − 3392 4095 B4 + 3392 455 ζ4 − 2735193382 553377825 ζ3 − 1689839813797 5113211103000 ζ2 ) +TFC2F ( −143797180510035170802620917 17429951855894984406000000 + 6784 4095 B4 −3392 455 ζ4 + 12917466836 774728955 ζ3 − 4139063104013 4747981738500 ζ2 ) +T 2FCF ( −337392441268078561 179653183425015300 + 54272 12285 ζ3 − 98112488 184459275 ζ2 ) +nfT 2FCF ( 222188365726202803 71861273370006120 − 3392 1755 ζ3 − 49056244 184459275 ζ2 ) . (F.30) (vi) a(3)gg,Q : a(3)gg,Q(2) = TFC2A ( −170227 4374 + 88 9 B4 − 72ζ4 + 31367 324 ζ3 − 1076 81 ζ2 ) +TFCFCA ( 154643 729 − 208 9 B4 + 104ζ4 − 7166 27 ζ3 + 54ζ2 ) +TFC2F ( 15574 243 + 64 9 B4 − 32ζ4 + 3421 81 ζ3 − 704 27 ζ2 ) +T 2FCA ( 20542 2187 − 4837 162 ζ3 + 670 81 ζ2 ) + T 2FCF ( −11696 729 − 569 81 ζ3 −256 9 ζ2 ) + 64 27 T 3F ζ3 + nfT 2FCA ( −76498 2187 + 1232 81 ζ3 − 40 81 ζ2 ) +nfT 2FCF ( 538 27 − 1792 81 ζ3 − 28 9 ζ2 ) , (F.31) a(3)gg,Q(4) = TFC2A ( 29043652079 291600000 + 533 25 B4 − 4698 25 ζ4 + 610035727 2592000 ζ3 + 92341 6750 ζ2 ) + TFCFCA ( 272542528639 874800000 − 1088 25 B4 + 4896 25 ζ4 −3642403 17280 ζ3 + 73274237 810000 ζ2 ) + TFC2F ( 41753961371 1749600000 163 + 44 25 B4 − 198 25 ζ4 + 2676077 64800 ζ3 − 4587077 1620000 ζ2 ) + T 2FCA ( −1192238291 14580000 −2134741 25920 ζ3 − 16091 675 ζ2 ) + T 2FCF ( −785934527 43740000 − 32071 8100 ζ3 −226583 8100 ζ2 ) + 64 27 T 3F ζ3 + nfT 2FCA ( −271955197 1822500 + 13216 405 ζ3 −6526 675 ζ2 ) + nfT 2FCF ( −465904519 27337500 − 6776 2025 ζ3 − 61352 10125 ζ2 ) , (F.32) a(3)gg,Q(6) = TFC2A ( 37541473421359 448084224000 + 56816 2205 B4 − 56376 245 ζ4 + 926445489353 2844979200 ζ3 + 11108521 555660 ζ2 ) + TFCFCA ( 18181142251969309 54890317440000 − 114512 2205 B4 + 57256 245 ζ4 −12335744909 67737600 ζ3 + 94031857 864360 ζ2 ) + TFC2F ( 16053159907363 635304600000 + 352 441 B4 −176 49 ζ4 + 3378458681 88905600 ζ3 − 8325229 10804500 ζ2 ) + T 2FCA ( −670098465769 6001128000 −25725061 259200 ζ3 − 96697 2835 ζ2 ) + T 2FCF ( −8892517283287 490092120000 − 12688649 2540160 ζ3 −2205188 77175 ζ2 ) + 64 27 T 3F ζ3 + nfT 2FCA ( −245918019913 1312746750 + 3224 81 ζ3 −250094 19845 ζ2 ) + nfT 2FCF ( −71886272797 3403417500 − 3872 2835 ζ3 − 496022 77175 ζ2 ) , (F.33) a(3)gg,Q(8) = TFC2A ( 512903304712347607 18665908531200000 + 108823 3780 B4 − 162587 630 ζ4 + 2735007975361 6502809600 ζ3 + 180224911 7654500 ζ2 ) +TFCFCA ( 13489584043443319991 43553786572800000 − 163882 2835 B4 + 81941 315 ζ4 −3504113623243 25082265600 ζ3 + 414844703639 3429216000 ζ2 ) +TFC2F ( 5990127272073225467 228657379507200000 + 37 81 B4 − 37 18 ζ4 + 3222019505879 87787929600 ζ3 164 −12144008761 48009024000 ζ2 ) + T 2FCA ( −16278325750483243 124439390208000 −871607413 7962624 ζ3 − 591287 14580 ζ2 ) + T 2FCF ( −7458367007740639 408316749120000 −291343229 52254720 ζ3 − 2473768763 85730400 ζ2 ) + 64 27 T 3F ζ3 +nfT 2FCA ( −102747532985051 486091368000 + 54208 1215 ζ3 − 737087 51030 ζ2 ) +nfT 2FCF ( −1145917332616927 51039593640000 − 2738 3645 ζ3 − 70128089 10716300 ζ2 ) , (F.34) a(3)gg,Q(10) = TFC2A ( −15434483462331661005275759 327337774462347264000000 + 17788828 571725 B4 −17746492 63525 ζ4 + 269094476549521109 519314374656000 ζ3 + 1444408720649 55468759500 ζ2 ) +TFCFCA ( 207095356146239371087405921 771581896946961408000000 − 35662328 571725 B4 + 17831164 63525 ζ4 − 3288460968359099 37093883904000 ζ3 + 6078270984602 46695639375 ζ2 ) +TFC2F ( 553777925867720521493231 20667372239650752000000 + 896 3025 B4 − 4032 3025 ζ4 + 7140954579599 198717235200 ζ3 − 282148432 4002483375 ζ2 ) +T 2FCA ( −63059843481895502807 433789788579840000 − 85188238297 729907200 ζ3 − 33330316 735075 ζ2 ) +T 2FCF ( −655690580559958774157 35787657557836800000 − 71350574183 12043468800 ζ3 − 3517889264 121287375 ζ2 ) + 64 27 T 3F ζ3 + nfT 2FCA ( −6069333056458984 26476427525625 + 215128 4455 ζ3 − 81362132 5145525 ζ2 ) +nfT 2FCF ( −100698363899844296 4368610541728125 − 351232 735075 ζ3 − 799867252 121287375 ζ2 ) . (F.35) 165 (vii) a(3),NSqq,Q : a(3),NSqq,Q (1) = 0 , (F.36) a(3),NSqq,Q (2) = TFCFCA ( 8744 2187 + 64 9 B4 − 64ζ4 + 4808 81 ζ3 − 64 81 ζ2 ) +TFC2F ( 359456 2187 − 128 9 B4 + 64ζ4 − 848 9 ζ3 + 2384 81 ζ2 ) +T 2FCF ( −28736 2187 − 2048 81 ζ3 − 512 81 ζ2 ) + nfT 2FCF ( −100096 2187 + 896 81 ζ3 − 256 81 ζ2 ) , (F.37) a(3),NSqq,Q (3) = TFCFCA ( 522443 34992 + 100 9 B4 − 100ζ4 + 15637 162 ζ3 + 175 162 ζ2 ) +TFC2F ( 35091701 139968 − 200 9 B4 + 100ζ4 − 1315 9 ζ3 + 29035 648 ζ2 ) +T 2FCF ( −188747 8748 − 3200 81 ζ3 − 830 81 ζ2 ) +nfT 2FCF ( −1271507 17496 + 1400 81 ζ3 − 415 81 ζ2 ) , (F.38) a(3),NSqq,Q (4) = TFCFCA ( 419369407 21870000 + 628 45 B4 − 628 5 ζ4 + 515597 4050 ζ3 + 10703 4050 ζ2 ) +TFC2F ( 137067007129 437400000 − 1256 45 B4 + 628 5 ζ4 − 41131 225 ζ3 + 4526303 81000 ζ2 ) + T 2FCF ( −151928299 5467500 − 20096 405 ζ3 − 26542 2025 ζ2 ) +nfT 2FCF ( −1006358899 10935000 + 8792 405 ζ3 − 13271 2025 ζ2 ) , (F.39) a(3),NSqq,Q (5) = TFCFCA ( 816716669 43740000 + 728 45 B4 − 728 5 ζ4 + 12569 81 ζ3 + 16103 4050 ζ2 ) +TFC2F ( 13213297537 36450000 − 1456 45 B4 + 728 5 ζ4 − 142678 675 ζ3 + 48391 750 ζ2 ) + T 2FCF ( −9943403 303750 − 23296 405 ζ3 − 31132 2025 ζ2 ) (F.40) 166 +nfT 2FCF ( −195474809 1822500 + 10192 405 ζ3 − 15566 2025 ζ2 ) , (F.41) a(3),NSqq,Q (6) = TFCFCA ( 1541550898907 105019740000 + 5672 315 B4 − 5672 35 ζ4 + 720065 3969 ζ3 + 1016543 198450 ζ2 ) + TFC2F ( 186569400917 463050000 −11344 315 B4 + 5672 35 ζ4 − 7766854 33075 ζ3 + 55284811 771750 ζ2 ) +T 2FCF ( −26884517771 729303750 − 181504 2835 ζ3 − 1712476 99225 ζ2 ) +nfT 2FCF ( −524427335513 4375822500 + 11344 405 ζ3 − 856238 99225 ζ2 ) , (F.42) a(3),NSqq,Q (7) = TFCFCA ( 5307760084631 672126336000 + 2054 105 B4 − 6162 35 ζ4 + 781237 3780 ζ3 + 19460531 3175200 ζ2 ) + TFC2F ( 4900454072126579 11202105600000 −4108 105 B4 + 6162 35 ζ4 − 8425379 33075 ζ3 + 1918429937 24696000 ζ2 ) +T 2FCF ( −8488157192423 210039480000 − 65728 945 ζ3 − 3745727 198450 ζ2 ) +nfT 2FCF ( −54861581223623 420078960000 + 4108 135 ζ3 − 3745727 396900 ζ2 ) , (F.43) a(3),NSqq,Q (8) = TFCFCA ( −37259291367883 38887309440000 + 19766 945 B4 − 19766 105 ζ4 + 1573589 6804 ζ3 + 200739467 28576800 ζ2 ) + TFC2F ( 3817101976847353531 8166334982400000 −39532 945 B4 + 19766 105 ζ4 − 80980811 297675 ζ3 + 497748102211 6001128000 ζ2 ) +T 2FCF ( −740566685766263 17013197880000 − 632512 8505 ζ3 − 36241943 1786050 ζ2 ) +nfT 2FCF ( −4763338626853463 34026395760000 + 39532 1215 ζ3 − 36241943 3572100 ζ2 ) , (F.44) 167 a(3),NSqq,Q (9) = TFCFCA ( −3952556872585211 340263957600000 + 4180 189 B4 − 4180 21 ζ4 + 21723277 85050 ζ3 + 559512437 71442000 ζ2 ) + TFC2F ( 1008729211999128667 2041583745600000 −8360 189 B4 + 4180 21 ζ4 − 85539428 297675 ζ3 + 131421660271 1500282000 ζ2 ) +T 2FCF ( −393938732805271 8506598940000 − 133760 1701 ζ3 − 19247947 893025 ζ2 ) +nfT 2FCF ( −2523586499054071 17013197880000 + 8360 243 ζ3 − 19247947 1786050 ζ2 ) , (F.45) a(3),NSqq,Q (10) = TFCFCA ( −10710275715721975271 452891327565600000 + 48220 2079 B4 −48220 231 ζ4 + 2873636069 10291050 ζ3 + 961673201 112266000 ζ2 ) +TFC2F ( 170291990048723954490137 328799103812625600000 − 96440 2079 B4 + 48220 231 ζ4 − 10844970868 36018675 ζ3 + 183261101886701 1996875342000 ζ2 ) +T 2FCF ( −6080478350275977191 124545115080540000 − 1543040 18711 ζ3 −2451995507 108056025 ζ2 ) + nfT 2FCF ( −38817494524177585991 249090230161080000 + 96440 2673 ζ3 − 2451995507 216112050 ζ2 ) , (F.46) a(3),NSqq,Q (11) = TFCFCA ( −22309979286641292041 603855103420800000 + 251264 10395 B4 −251264 1155 ζ4 + 283300123 935550 ζ3 + 1210188619 130977000 ζ2 ) +TFC2F ( 177435748292579058982241 328799103812625600000 − 502528 10395 B4 + 251264 1155 ζ4 − 451739191 1440747 ζ3 + 47705202493793 499218835500 ζ2 ) 168 +T 2FCF ( −6365809346912279423 124545115080540000 − 8040448 93555 ζ3 −512808781 21611205 ζ2 ) + nfT 2FCF ( −40517373495580091423 249090230161080000 + 502528 13365 ζ3 − 512808781 43222410 ζ2 ) , (F.47) a(3),NSqq,Q (12) = TFCFCA ( −126207343604156227942043 2463815086971638400000 + 3387392 135135 B4 −3387392 15015 ζ4 + 51577729507 158107950 ζ3 + 2401246832561 243486243000 ζ2 ) +TFC2F ( 68296027149155250557867961293 122080805651901196900800000 − 6774784 135135 B4 + 3387392 15015 ζ4 − 79117185295 243486243 ζ3 + 108605787257580461 1096783781593500 ζ2 ) +T 2FCF ( −189306988923316881320303 3557133031815302940000 − 108396544 1216215 ζ3 −90143221429 3652293645 ζ2 ) + nfT 2FCF ( −1201733391177720469772303 7114266063630605880000 + 6774784 173745 ζ3 − 90143221429 7304587290 ζ2 ) , (F.48) a(3),NSqq,Q (13) = TFCFCA ( −12032123246389873565503373 181090408892415422400000 + 3498932 135135 B4 −3498932 15015 ζ4 + 2288723461 6548850 ζ3 + 106764723181157 10226422206000 ζ2 ) +TFC2F ( 10076195142551036234891679659 17440115093128742414400000 − 6997864 135135 B4 + 3498932 15015 ζ4 − 81672622894 243486243 ζ3 + 448416864235277759 4387135126374000 ζ2 ) +T 2FCF ( −196243066652040382535303 3557133031815302940000 − 111965824 1216215 ζ3 −93360116539 3652293645 ζ2 ) + nfT 2FCF ( −1242840812874342588467303 7114266063630605880000 169 + 6997864 173745 ζ3 − 93360116539 7304587290 ζ2 ) , (F.49) a(3),NSqq,Q (14) = TFCFCA ( −994774587614536873023863 12072693926161028160000 + 720484 27027 B4 −720484 3003 ζ4 + 6345068237 17027010 ζ3 + 37428569944327 3408807402000 ζ2 ) +TFC2F ( 72598193631729215117875463981 122080805651901196900800000 − 1440968 27027 B4 + 720484 3003 ζ4 − 2101051892878 6087156075 ζ3 + 461388998135343407 4387135126374000 ζ2 ) +T 2FCF ( −40540032063650894708251 711426606363060588000 − 23055488 243243 ζ3 −481761665447 18261468225 ζ2 ) + nfT 2FCF ( −256205552272074402170491 1422853212726121176000 + 1440968 34749 ζ3 − 481761665447 36522936450 ζ2 ) . (F.50) 170 G 3–loop Moments for Transversity We obtain the following fixed moments of the fermionic contributions to the 3–loop transversity anomalous dimension γ(2),TRqq (N) γˆ(2),TRqq (1) = CFTF [ −8 3 TF (1 + 2nf )− 2008 27 CA + 196 9 CF + 32(CF − CA)ζ3 ] , (G.1) γˆ(2),TRqq (2) = CFTF [ −184 27 TF (1 + 2nf )− 2084 27 CA −60CF + 96(CF − CA)ζ3 ] , (G.2) γˆ(2),TRqq (3) = CFTF [ −2408 243 TF (1 + 2nf )− 19450 243 CA −25276 243 CF + 416 3 (CF − CA)ζ3 ] , (G.3) γˆ(2),TRqq (4) = CFTF [ −14722 1215 TF (1 + 2nf )− 199723 2430 CA −66443 486 CF + 512 3 (CF − CA)ζ3 ] , (G.4) γˆ(2),TRqq (5) = CFTF [ −418594 30375 TF (1 + 2nf )− 5113951 60750 CA −49495163 303750 CF + 2944 15 (CF − CA)ζ3 ] , (G.5) γˆ(2),TRqq (6) = CFTF [ −3209758 212625 TF (1 + 2nf )− 3682664 42525 CA −18622301 101250 CF + 1088 5 (CF − CA)ζ3 ] , (G.6) γˆ(2),TRqq (7) = CFTF [ −168501142 10418625 TF (1 + 2nf )− 1844723441 20837250 CA −49282560541 243101250 CF + 8256 35 (CF − CA)ζ3 ] (G.7) γˆ(2),TRqq (8) = CFTF [ −711801943 41674500 TF (1 + 2nf )− 6056338297 66679200 CA 171 −849420853541 3889620000 CF + 8816 35 (CF − CA)ζ3 ] (G.8) These moments (N = 1..8) agree with the corresponding terms obtained in [360]. The newly calculated moments read γˆ(2),TRqq (9) = CFTF [ −20096458061 1125211500 TF (1 + 2nf )− 119131812533 1285956000 CA −24479706761047 105019740000 CF + 83824 315 (CF − CA)ζ3 ] (G.9) γˆ(2),TRqq (10) = CFTF [ −229508848783 12377326500 TF (1 + 2nf )− 4264058299021 45008460000 CA −25800817445759 105019740000 CF + 87856 315 (CF − CA)ζ3 ] (G.10) γˆ(2),TRqq (11) = CFTF [ −28677274464343 1497656506500 TF (1 + 2nf )− 75010870835743 778003380000 CA −396383896707569599 1537594013340000 CF + 1006736 3465 (CF − CA)ζ3 ] (G.11) γˆ(2),TRqq (12) = CFTF [ −383379490933459 19469534584500 TF (1 + 2nf ) −38283693844132279 389390691690000 CA −1237841854306528417 4612782040020000 CF + 1043696 3465 (CF − CA)ζ3 ] (G.12) γˆ(2),TRqq (13) = CFTF [ −66409807459266571 3290351344780500 TF (1 + 2nf ) −6571493644375020121 65807026895610000 CA −36713319015407141570017 131745667845011220000 CF + 14011568 45045 (CF − CA)ζ3 ] . (G.13) The fixed moments of the constant terms a(3),TRqq,Q (N) of the unrenormalized OME, see Eq. (9.15), are given by a(3),TRqq,Q (1) = TFCFCA ( −26441 1458 + 8 3 B4 − 24ζ4 + 481 27 ζ3 − 61 27 ζ2 ) +TFC2F ( 15715 162 − 16 3 B4 + 24ζ4 − 278 9 ζ3 + 49 3 ζ2 ) 172 +T 2FCF ( −6548 729 − 256 27 ζ3 − 104 27 ζ2 ) +nfT 2FCF ( −15850 729 + 112 27 ζ3 − 52 27 ζ2 ) , (G.14) a(3),TRqq,Q (2) = TFCFCA ( 1043 162 + 8B4 − 72ζ4 + 577 9 ζ3 + ζ2 3 ) +TFC2F ( 10255 54 − 16B4 + 72ζ4 − 310 3 ζ3 + 33ζ2 ) +T 2FCF ( −1388 81 − 256 9 ζ3 − 8ζ2 ) +nfT 2FCF ( −4390 81 + 112 9 ζ3 − 4ζ2 ) , (G.15) a(3),TRqq,Q (3) = TFCFCA ( 327967 21870 + 104 9 B4 − 104ζ4 + 40001 405 ζ3 + 121 81 ζ2 ) +TFC2F ( 1170943 4374 − 208 9 B4 + 104ζ4 − 1354 9 ζ3 + 3821 81 ζ2 ) +T 2FCF ( −52096 2187 − 3328 81 ζ3 − 904 81 ζ2 ) +nfT 2FCF ( −168704 2187 + 1456 81 ζ3 − 452 81 ζ2 ) , (G.16) a(3),TRqq,Q (4) = TFCFCA ( 4400353 218700 + 128 9 B4 − 128ζ4 + 52112 405 ζ3 + 250 81 ζ2 ) +TFC2F ( 56375659 174960 − 256 9 B4 + 128ζ4 − 556 3 ζ3 + 4616 81 ζ2 ) +T 2FCF ( −3195707 109350 − 4096 81 ζ3 − 1108 81 ζ2 ) +nfT 2FCF ( −20731907 218700 + 1792 81 ζ3 − 554 81 ζ2 ) , (G.17) a(3),TRqq,Q (5) = TFCFCA ( 1436867309 76545000 + 736 45 B4 − 736 5 ζ4 + 442628 2835 ζ3 + 8488 2025 ζ2 ) +TFC2F ( 40410914719 109350000 − 1472 45 B4 + 736 5 ζ4 − 47932 225 ζ3 + 662674 10125 ζ2 ) 173 +T 2FCF ( −92220539 2733750 − 23552 405 ζ3 − 31924 2025 ζ2 ) +nfT 2FCF ( −596707139 5467500 + 10304 405 ζ3 − 15962 2025 ζ2 ) , (G.18) a(3),TRqq,Q (6) = TFCFCA ( 807041747 53581500 + 272 15 B4 − 816 5 ζ4 + 172138 945 ζ3 + 10837 2025 ζ2 ) + TFC2F ( 14845987993 36450000 − 544 15 B4 + 816 5 ζ4 − 159296 675 ζ3 + 81181 1125 ζ2 ) + T 2FCF ( −5036315611 133953750 − 8704 135 ζ3 − 35524 2025 ζ2 ) +nfT 2FCF ( −32472719011 267907500 + 3808 135 ζ3 − 17762 2025 ζ2 ) , (G.19) a(3),TRqq,Q (7) = TFCFCA ( 413587780793 52509870000 + 688 35 B4 − 6192 35 ζ4 + 27982 135 ζ3 + 620686 99225 ζ2 ) + TFC2F ( 12873570421651 29172150000 − 1376 35 B4 + 6192 35 ζ4 −8454104 33075 ζ3 + 90495089 1157625 ζ2 ) + T 2FCF ( −268946573689 6563733750 − 22016 315 ζ3 −1894276 99225 ζ2 ) + nfT 2FCF ( −1727972700289 13127467500 + 1376 45 ζ3 − 947138 99225 ζ2 ) , (G.20) a(3),TRqq,Q (8) = TFCFCA ( − 91321974347 112021056000 + 2204 105 B4 − 6612 35 ζ4 + 87613 378 ζ3 + 11372923 1587600 ζ2 ) + TFC2F ( 1316283829306051 2800526400000 − 4408 105 B4 + 6612 35 ζ4 −9020054 33075 ζ3 + 171321401 2058000 ζ2 ) + T 2FCF ( −4618094363399 105019740000 − 70528 945 ζ3 −2030251 99225 ζ2 ) + nfT 2FCF ( −29573247248999 210039480000 + 4408 135 ζ3 − 2030251 198450 ζ2 ) , (G.21) a(3),TRqq,Q (9) = TFCFCA ( −17524721583739067 1497161413440000 + 20956 945 B4 − 20956 105 ζ4 + 9574759 37422 ζ3 + 16154189 2041200 ζ2 ) + TFC2F ( 1013649109952401819 2041583745600000 − 41912 945 B4 174 + 20956 105 ζ4 − 85698286 297675 ζ3 + 131876277049 1500282000 ζ2 ) +T 2FCF ( −397003835114519 8506598940000 − 670592 8505 ζ3 − 19369859 893025 ζ2 ) +nfT 2FCF ( −2534665670688119 17013197880000 + 41912 1215 ζ3 − 19369859 1786050 ζ2 ) , (G.22) a(3),TRqq,Q (10) = TFCFCA ( −176834434840947469 7485807067200000 + 21964 945 B4 − 21964 105 ζ4 + 261607183 935550 ζ3 + 618627019 71442000 ζ2 ) + TFC2F ( 11669499797141374121 22457421201600000 −43928 945 B4 + 21964 105 ζ4 − 3590290 11907 ζ3 + 137983320397 1500282000 ζ2 ) +T 2FCF ( −50558522757917663 1029298471740000 − 702848 8505 ζ3 − 4072951 178605 ζ2 ) +nfT 2FCF ( −321908083399769663 2058596943480000 + 43928 1215 ζ3 − 4072951 357210 ζ2 ) , (G.23) a(3),TRqq,Q (11) = TFCFCA ( −436508000489627050837 11775174516705600000 + 251684 10395 B4 − 251684 1155 ζ4 + 3687221539 12162150 ζ3 + 149112401 16038000 ζ2 ) + TFC2F ( 177979311179110818909401 328799103812625600000 −503368 10395 B4 + 251684 1155 ζ4 − 452259130 1440747 ζ3 + 191230589104127 1996875342000 ζ2 ) +T 2FCF ( −6396997235105384423 124545115080540000 − 8053888 93555 ζ3 − 514841791 21611205 ζ2 ) +nfT 2FCF ( −40628987857774916423 249090230161080000 + 503368 13365 ζ3 − 514841791 43222410 ζ2 ) , (G.24) a(3),TRqq,Q (12) = TFCFCA ( −245210883820358086333 4783664647411650000 + 260924 10395 B4 − 260924 1155 ζ4 + 3971470819 12162150 ζ3 + 85827712409 8644482000 ζ2 ) + TFC2F ( 2396383721714622551610173 4274388349564132800000 −521848 10395 B4 + 260924 1155 ζ4 − 468587596 1440747 ζ3 + 198011292882437 1996875342000 ζ2 ) 175 +T 2FCF ( −1124652164258976877487 21048124448611260000 − 8349568 93555 ζ3 −535118971 21611205 ζ2 ) + nfT 2FCF ( −7126865031281296825487 42096248897222520000 + 521848 13365 ζ3 − 535118971 43222410 ζ2 ) , (G.25) a(3),TRqq,Q (13) = TFCFCA ( −430633219615523278883051 6467514603300550800000 + 3502892 135135 B4 −3502892 15015 ζ4 + 327241423 935550 ζ3 + 15314434459241 1460917458000 ζ2 ) +TFC2F ( 70680445585608577308861582893 122080805651901196900800000 − 7005784 135135 B4 + 3502892 15015 ζ4 − 81735983092 243486243 ζ3 + 449066258795623169 4387135126374000 ζ2 ) +T 2FCF ( −196897887865971730295303 3557133031815302940000 − 112092544 1216215 ζ3 −93611152819 3652293645 ζ2 ) + nfT 2FCF ( −1245167831299024242467303 7114266063630605880000 + 7005784 173745 ζ3 − 93611152819 7304587290 ζ2 ) . 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Schneider for help with the use of Sigma. Further thanks go to B. To¨dtli and K. Litten for reading parts of the manuscript. Finally, I also would like to thank my family, Frank, Katharina, Max and Ute for moral support. This work was supported in part by DFG Sonderforschungsbereich Transregio 9, Com- putergestu¨tzte Theoretische Teilchenphysik, Studienstiftung des Deutschen Volkes, the European Commission MRTN HEPTOOLS under Contract No. MRTN-CT-2006-035505, and DESY. I thank both IT groups of DESY providing me access to special facilities to perform the calculations involved in this thesis. Diese Dissertation beinhaltet Beitra¨ge zu folgenden Vero¨ffentlichungen: i) Publikationen: Journale 1. Mellin Moments of the O(α3s) Heavy Flavor Contributions to unpolarized Deep-Inelastic Scattering at Q2 ≫ m2 and Anomalous Dimensions I. Bierenbaum, J. Blu¨mlein and S. Klein Nucl. Phys. B (in print) (2009) [arXiv:hep-ph/0904.3563]. 2. Determining the closed forms of the O(a3s) anomalous dimensions and Wilson coefficients from Mellin moments by means of computer algebra J. Blu¨mlein, M. Kauers, S. Klein and C. Schneider Comput. Phys. Commun. (in print) [arXiv:hep-ph/0902.4091]. 3. The Gluonic Operator Matrix Elements at O(α2s) for DIS Heavy Flavor Production I. Bierenbaum, J. Blu¨mlein and S. Klein Phys. Lett. B672, 401 (2009) [arXiv:hep-ph/0901.0669]. 4. Two–Loop Massive Operator Matrix Elements for Unpolarized Heavy Flavor Production to O(ǫ) I. Bierenbaum, J. Blu¨mlein, S. Klein and C. Schneider Nucl. Phys. B803, 1 (2008) [arXiv:hep-ph/0803.0273]. ii) Beitra¨ge zu Konferenzba¨nden 5. 2– and 3–loop heavy flavor contributions to F2(x,Q2), FL(x,Q2) and g1,2(x,Q2) I. Bierenbaum, J. Blu¨mlein and S. Klein in: Proceedings of the workshop: HERA and the LHC workshop series on the implica- tions of HERA for LHC physics, H. Jung and A. De Roeck, eds., (2006–2008, Hamburg, Geneve), DESY-PROC-2009-02, March 2009, pp. 363 [arXiv:hep-ph/0903.3861]. 6. From Moments to Functions in Quantum Chromodynamics J. Blu¨mlein, M. Kauers, S. Klein and C. Schneider PoS ACAT 2008, 106 (2008) [arXiv:hep-ph/0902.4095]. 7. Heavy flavor operator matrix elements at O(a3s) I. Bierenbaum, J. Blu¨mlein and S. Klein PoS Confinement8, 185 (2008) [arXiv:hep-ph/0812.2427]. 8. First O(α3s ) heavy flavor contributions to deeply inelastic scattering I. Bierenbaum, J. Blu¨mlein and S. Klein Nucl. Phys. Proc. Suppl. 183, 162 (2008) [arXiv:hep-ph/0806.4613]. 9. Higher order corrections to heavy flavour production in deep inelastic scattering I. Bierenbaum, J. Blu¨mlein and S. Klein Acta Phys. Polon. B39, 1531 (2008) [arXiv:hep-ph/0806.0451]. 10. Heavy flavour production in deep–inelastic scattering - Two–loop massive operator matrix elements and beyond I. Bierenbaum, J. Blu¨mlein and S. Klein Acta Phys. Polon. B38, 3543 (2007); PoS RADCOR 2007, 034 (2007) [arXiv:hep- ph/0710.3348]. 11. Difference Equations in Massive Higher Order Calculations I. Bierenbaum, J. Blu¨mlein, S. Klein and C. Schneider PoS ACAT 2007, 082 (2007) [arXiv:math-ph/0707.4659]. 12. Two-loop massive operator matrix elements for polarized and unpolar- ized deep-inelastic scattering I. Bierenbaum, J. Blu¨mlein and S. Klein in: Proc. of 15th International Workshop On Deep-Inelastic Scattering And Related Subjects (DIS2007), G. Grindhammer, K. Sachs, eds., (16–20 April 2007, Munich), Vol. 2, pp. 821 [arXiv:hep-ph/0706.2738]. 13. Structural Relations between Harmonic Sums up to w=6 J. Blu¨mlein and S. Klein PoS ACAT, 084 (2007) [arXiv/hep-ph:0706.2426]. 14. Two–loop massive operator matrix elements for polarized and unpolar- ized deep-inelastic scattering I. Bierenbaum, J. Blu¨mlein and S. Klein PoS ACAT, 070 (2007). Selbststa¨ndigkeitserkla¨rung Ich erkla¨re an Eides statt, dass außer den in der Dissertation angegebenen Quellen keine weiteren Hilfsmittel verwendet wurden. Die Arbeit wurde bisher weder zu einer Promotion noch zu anderen Pru¨fungen verwendet. Sebastian Klein, Dortmund den 5. Juni 2009.