WorldWideScience

Sample records for renormalized coupling constant

  1. QCD One-Loop Effective Coupling Constant and Quark Mass Given in a Mass-Dependent Renormalization

    Institute of Scientific and Technical Information of China (English)

    SU Jun-Chen; SHAN Lian-You; CAO Ying-Hui

    2001-01-01

    The QCD one-loop renormalization is restudied in a mass-dependent subtraction scheme in which the quark mass is not set to vanish and the renormalization point is chosen to be an arbitrary time-like momentum. The correctness of the subtraction is ensured by the Ward identities which are respected in all the processes of subtraction.By considering the mass effect, the effective coupling constant and the effective quark masses derived by solving the renormalization group equations are given in improved expressions which are different from the previous results.PACS numbers: 11.10.Gh, 11.10.Hi, 12.38.-t, 12.38.Bx

  2. Renormalized. pi. NN coupling constant and the P-italic-wave phase shifts in the cloudy bag model

    Energy Technology Data Exchange (ETDEWEB)

    Pearce, B.C.; Afnan, I.R.

    1986-09-01

    Most applications of the cloudy bag model to ..pi..N scattering involve unitarizing the bare diagrams arising from the Lagrangian by iterating in a Lippmann-Schwinger equation. However, analyses of the renormalization of the coupling constant proceed by iterating the Lagrangian to a given order in the bare coupling constant. These two different approaches means there is an inconsistency between the calculation of phase shifts and the calculation of renormalization. A remedy to this problem is presented that has the added advantage of improving the fit to the phase shifts in the P-italic/sub 11/ channel. This is achieved by using physical values of the coupling constant in the crossed diagram which reduces the repulsion rather than adds attraction. This approach can be justified by examining equations for the ..pi pi..N system that incorporate three-body unitarity.

  3. Renormalized πNN coupling constant and the P-wave phase shifts in the cloudy bag model

    Science.gov (United States)

    Pearce, B. C.; Afnan, I. R.

    1986-09-01

    Most applications of the cloudy bag model to πN scattering involve unitarizing the bare diagrams arising from the Lagrangian by iterating in a Lippmann-Schwinger equation. However, analyses of the renormalization of the coupling constant proceed by iterating the Lagrangian to a given order in the bare coupling constant. These two different approaches means there is an inconsistency between the calculation of phase shifts and the calculation of renormalization. A remedy to this problem is presented that has the added advantage of improving the fit to the phase shifts in the P11 channel. This is achieved by using physical values of the coupling constant in the crossed diagram which reduces the repulsion rather than adds attraction. This approach can be justified by examining equations for the ππN system that incorporate three-body unitarity.

  4. RI/MOM renormalization constants (N_f=4) and the strong coupling constant (N_f=2+1+1) from twisted-mass QCD

    CERN Document Server

    Blossier, B; Brinet, M; De Soto, F; Du, X; Gravina, M; Liu, Z; Morenas, V; Pène, O; Petrov, K; Rodríguez-Quintero, J

    2011-01-01

    We study RI/MOM renormalization constants of bilinear quark operators for $N_f=4$ and the strong coupling constant for $N_f=2+1+1$ using Wilson twisted-mass fermions. We use the "egalitarian" method to remove H(4) hypercubic artifacts non-perturbatively, which enables us to study physical quantities in a wide range of momenta. We then apply OPE in studying the running behavior of $Z_q$ and $\\alpha_s$, from which we are able to extract the Landau gauge dimension-two gluon condensate $$ which is of phenomenological interest.

  5. Renormalized coupling constants for 3D scalar \\lambda\\phi^4 field theory and pseudo-\\epsilon-expansion

    CERN Document Server

    Nikitina, M A

    2016-01-01

    Renormalized coupling constants g_{2k} that enter the critical equation of state and determine nonlinear susceptibilities of the system possess universal values g*_{2k} at the Curie point. They are calculated, along with the ratios R_{2k} = g_{2k}/g_4^{k-1}, for the three-dimensional scalar \\lambda\\phi^4 field theory within the pseudo-\\epsilon-expansion approach. Pseudo-\\epsilon-expansions for g*_6, g*_8, R*_6, and R*_8 are derived in the five-loop approximation, numerical estimates are presented for R*_6 and R*_8. The higher-order coefficients of the pseudo-\\epsilon-expansions for the sextic coupling are so small that simple Pade approximants turn out to be sufficient to yield very good numerical results. Their use gives R*_6 = 1.650 while the most recent lattice estimate is R*_6 = 1.649(2). For the octic coupling pseudo-\\epsilon-expansions are less favorable from the numerical point of view. Nevertheless, Pade-Borel resummation leads in this case to R*_8 = 0.890, the number differing only slightly from the ...

  6. Toward Reliable Prediction of Hyperfine Coupling Constants Using Ab Initio Density Matrix Renormalization Group Method: Diatomic (2)Σ and Vinyl Radicals as Test Cases.

    Science.gov (United States)

    Lan, Tran Nguyen; Kurashige, Yuki; Yanai, Takeshi

    2014-05-13

    The density matrix renormalization group (DMRG) method is used in conjunction with the complete active space (CAS) procedure, the CAS configuration interaction (CASCI), and the CAS self-consistent field (CASSCF) to evaluate hyperfine coupling constants (HFCCs) for a series of diatomic (2)Σ radicals (BO, CO(+), CN, and AlO) and vinyl (C2H3) radical. The electron correlation effects on the computed HFCC values were systematically investigated using various levels of active space, which were increasingly extended from single valence space to large-size model space entailing double valence and at least single polarization shells. In addition, the core correlation was treated by including the core orbitals in active space. Reasonably accurate results were obtained by the DMRG-CASSCF method involving orbital optimization, while DMRG-CASCI calculations with Hartree-Fock orbitals provided poor agreement of the HFCCs with the experimental values. To achieve further insights into the accuracy of HFCC calculations, the orbital contributions to the total spin density were analyzed at a given nucleus, which is directly related to the FC term and is numerically sensitive to the level of correlation treatment and basis sets. The convergence of calculated HFCCs with an increasing number of renormalized states was also assessed. This work serves as the first study on the performance of the ab initio DMRG method for HFCC prediction.

  7. Renormalization constants and beta functions for the gauge couplings of the Standard Model to three-loop order

    CERN Document Server

    Mihaila, Luminita N; Steinhauser, Matthias

    2012-01-01

    We compute the beta functions for the three gauge couplings of the Standard Model in the minimal subtraction scheme to three loops. We take into account contributions from all sectors of the Standard Model. The calculation is performed using both Lorenz gauge in the unbroken phase of the Standard Model and background field gauge in the spontaneously broken phase. Furthermore, we describe in detail the treatment of $\\gamma_5$ and present the automated setup which we use for the calculation of the Feynman diagrams. It starts with the generation of the Feynman rules and leads to the bare result for the Green's function of a given process.

  8. Renormalization Constants of Quark Operators for the Non-Perturbatively Improved Wilson Action

    CERN Document Server

    Becirevic, D; Lubicz, V; Martinelli, G; Papinutto, Mauro; Reyes, J

    2004-01-01

    We present the results of an extensive lattice calculation of the renormalization constants of bilinear and four-quark operators for the non-perturbatively O(a)-improved Wilson action. The results are obtained in the quenched approximation at four values of the lattice coupling by using the non-perturbative RI/MOM renormalization method. Several sources of systematic uncertainties, including discretization errors and final volume effects, are examined. The contribution of the Goldstone pole, which in some cases may affect the extrapolation of the renormalization constants to the chiral limit, is non-perturbatively subtracted. The scale independent renormalization constants of bilinear quark operators have been also computed by using the lattice chiral Ward identities approach and compared with those obtained with the RI-MOM method. For those renormalization constants the non-perturbative estimates of which have been already presented in the literature we find an agreement which is typically at the level of 1%...

  9. Perturbatively improving RI-MOM renormalization constants

    Energy Technology Data Exchange (ETDEWEB)

    Constantinou, M.; Costa, M.; Panagopoulos, H. [Cyprus Univ. (Cyprus). Dept. of Physics; Goeckeler, M. [Regensburg Univ. (Germany). Institut fuer Theoretische Physik; Horsley, R. [Edinburgh Univ. (United Kingdom). School of Physics; Perlt, H.; Schiller, A. [Leipzig Univ. (Germany). Inst. fuer Theoretische Physik; Rakow, P.E.L. [Liverpool Univ. (United Kingdom). Dept. of Mathematical Sciences; Schhierholz, G. [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany)

    2013-03-15

    The determination of renormalization factors is of crucial importance in lattice QCD. They relate the observables obtained on the lattice to their measured counterparts in the continuum in a suitable renormalization scheme. Therefore, they have to be computed as precisely as possible. A widely used approach is the nonperturbative Rome-Southampton method. It requires, however, a careful treatment of lattice artifacts. In this paper we investigate a method to suppress these artifacts by subtracting one-loop contributions to renormalization factors calculated in lattice perturbation theory. We compare results obtained from a complete one-loop subtraction with those calculated for a subtraction of contributions proportional to the square of the lattice spacing.

  10. Perturbatively improving RI-MOM renormalization constants

    Energy Technology Data Exchange (ETDEWEB)

    Constantinou, M.; Costa, M.; Panagopoulos, H. [Cyprus Univ. (Cyprus). Dept. of Physics; Goeckeler, M. [Regensburg Univ. (Germany). Institut fuer Theoretische Physik; Horsley, R. [Edinburgh Univ. (United Kingdom). School of Physics; Perlt, H.; Schiller, A. [Leipzig Univ. (Germany). Inst. fuer Theoretische Physik; Rakow, P.E.L. [Liverpool Univ. (United Kingdom). Dept. of Mathematical Sciences; Schhierholz, G. [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany)

    2013-03-15

    The determination of renormalization factors is of crucial importance in lattice QCD. They relate the observables obtained on the lattice to their measured counterparts in the continuum in a suitable renormalization scheme. Therefore, they have to be computed as precisely as possible. A widely used approach is the nonperturbative Rome-Southampton method. It requires, however, a careful treatment of lattice artifacts. In this paper we investigate a method to suppress these artifacts by subtracting one-loop contributions to renormalization factors calculated in lattice perturbation theory. We compare results obtained from a complete one-loop subtraction with those calculated for a subtraction of contributions proportional to the square of the lattice spacing.

  11. Renormalization constants for 2-twist operators in twisted mass QCD

    CERN Document Server

    Alexandrou, C; Korzec, T; Panagopoulos, H; Stylianou, F

    2010-01-01

    Perturbative and non-perturbative results on the renormalization constants of the fermion field and the twist-2 fermion bilinears are presented with emphasis on the non-perturbative evaluation of the one-derivative twist-2 vector and axial vector operators. Non-perturbative results are obtained using the twisted mass Wilson fermion formulation employing two degenerate dynamical quarks and the tree-level Symanzik improved gluon action. The simulations have been performed for pion masses in the range of about 450-260 MeV and at three values of the lattice spacing $a$ corresponding to $\\beta=3.9, 4.05, 4.20$. Subtraction of ${\\cal O}(a^2)$ terms is carried out by performing the perturbative evaluation of these operators at 1-loop and up to ${\\cal O}(a^2)$. The renormalization conditions are defined in the RI$'$-MOM scheme, for both perturbative and non-perturbative results. The renormalization factors, obtained for different values of the renormalization scale, are evolved perturbatively to a reference scale set...

  12. Scalar relativistic calculations of hyperfine coupling constants using ab initio density matrix renormalization group method in combination with third-order Douglas-Kroll-Hess transformation: case studies on 4d transition metals.

    Science.gov (United States)

    Nguyen Lan, Tran; Kurashige, Yuki; Yanai, Takeshi

    2015-01-13

    We have developed a new computational scheme for high-accuracy prediction of the isotropic hyperfine coupling constant (HFCC) of heavy molecules, accounting for the high-level electron correlation effects, as well as the scalar-relativistic effects. For electron correlation, we employed the ab initio density matrix renormalization group (DMRG) method in conjunction with a complete active space model. The orbital-optimization procedure was employed to obtain the optimized orbitals required for accurately determining the isotropic HFCC. For the scalar-relativistic effects, we initially derived and implemented the Douglas-Kroll-Hess (DKH) hyperfine coupling operators up to the third order (DKH3) by using the direct transformation scheme. A set of 4d transition-metal radicals consisting of Ag atom, PdH, and RhH2 were chosen as test cases. Good agreement between the isotropic HFCC values obtained from DMRG/DKH3 and experiment was archived. Because there are no available gas-phase values for PdH and RhH2 radicals in the literature, the results from the present high-level theory may serve as benchmark data.

  13. Extended renormalizations group analysis for quantum gravity and Newton's gravitational constant

    Energy Technology Data Exchange (ETDEWEB)

    El Naschie, M.S. [Department of Physics, University of Alexandria (Egypt); Donghua University, Shanghai (China)], E-mail: Chaossf@aol.com

    2008-02-15

    The conventional renormalization groups as applied in SU(5) GUT are adapted to the transfinite simplictic arithmetic of E-infinity theory. The resulting simple formalism yielded the exact quantum gravity inverse coupling for non-super symmetric and super symmetric unifications alike. Subsequently by means of analogy supported by Witten's T-duality and black hole theory an accurate estimation of Newton's constant of gravity is derived from what is basically the same formalism.

  14. Renormalization constants of local operators for Wilson type improved fermions

    CERN Document Server

    Alexandrou, C; Korzec, T; Panagopoulos, H; Stylianou, F

    2012-01-01

    Perturbative and non-perturbative results are presented on the renormalization constants of the quark field and the vector, axial-vector, pseudoscalar, scalar and tensor currents. The perturbative computation, carried out at one-loop level and up to second order in the lattice spacing, is performed for a fermion action, which includes the clover term and the twisted mass parameter yielding results that are applicable for unimproved Wilson fermions, as well as for improved clover and twisted mass fermions. We consider ten variants of the Symanzik improved gauge action corresponding to ten different values of the plaquette coefficients. Non-perturbative results are obtained using the twisted mass Wilson fermion formulation employing two degenerate dynamical quarks and the tree-level Symanzik improved gluon action. The simulations are performed for pion masses in the range of 480 MeV to 260 MeV and at three values of the lattice spacing, a, corresponding to beta=3.9, 4.05, 4.20. For each renormalization factor c...

  15. Renormalization constants for Wilson fermion lattice QCD with four dynamical flavours

    CERN Document Server

    Dimopoulos, P; Herdoiza, G; Jansen, K; Lubicz, V; Palao, D; Rossi, G C

    2010-01-01

    We report on an ongoing non-perturbative computation of RI-MOM scheme renormalization constants for the lattice action with four dynamical flavours currently in use by ETMC. For this goal dedicated simulations with four degenerate sea quark flavours are performed at several values of the standard and twisted quark mass parameters. We discuss a method for removing possible O(a) artifacts at all momenta and extrapolating renormalization constant estimators to the chiral limit. We give preliminary results at one lattice spacing.

  16. Three pion nucleon coupling constants

    CERN Document Server

    Arriola, E Ruiz; Perez, R Navarro

    2016-01-01

    There exist four pion nucleon coupling constants, $f_{\\pi^0, pp}$, $-f_{\\pi^0, nn}$, $f_{\\pi^+, pn} /\\sqrt{2}$ and $ f_{\\pi^-, np} /\\sqrt{2}$ which coincide when up and down quark masses are identical and the electron charge is zero. While there is no reason why the pion-nucleon-nucleon coupling constants should be identical in the real world, one expects that the small differences might be pinned down from a sufficiently large number of independent and mutually consistent data. Our discussion provides a rationale for our recent determination $$f_p^2 = 0.0759(4) \\, , \\quad f_{0}^2 = 0.079(1) \\,, \\quad f_{c}^2 = 0.0763(6) \\, , $$ based on a partial wave analysis of the $3\\sigma$ self-consistent nucleon-nucleon Granada-2013 database comprising 6713 published data in the period 1950-2013.

  17. Renormalization constants for $N_{\\rm f}=2+1+1$ twisted mass QCD

    CERN Document Server

    Blossier, Benoit; Guichon, Pierre; Morénas, Vincent; Pène, Olivier; Rodríguez-Quintero, Jose; Zafeiropoulos, Savvas

    2014-01-01

    We summarize recent non-perturbative results obtained for the renormalization constants computed in the RI'-MOM scheme for $N_{\\rm f}=2+1+1$ twisted mass QCD. Our implementation employs the Iwasaki gauge action and four dynamical degenerate twisted mass fermions. Renormalization constants for scalar, pseudo-scalar, vector and axial operators, as well as the quark propagator renormalization, are computed at three different values of the lattice spacing, two different volumes and several values of the twisted mass. Our method allows for a precise cross-check of the running, because of the particular proper treatment of the hypercubic artifacts. Preliminary results for twist-2 operators are also presented.

  18. Gauge coupling renormalization in RS1

    Science.gov (United States)

    Agashe, K.; Delgado, A.; Sundrum, R.

    2002-11-01

    We compute the 4D low energy effective gauge coupling at one-loop order in the compact Randall-Sundrum scenario with bulk gauge fields and charged matter, within controlled approximations. While such computations are subtle, they can be important for studying phenomenological issues such as grand unification. Ultraviolet divergences are cut-off using Pauli-Villars regularization so as to respect 5D gauge and general coordinate invariance. The structure of these divergences on branes and in the bulk is elucidated by a 5D position-space analysis. The remaining finite contributions are obtained by a careful analysis of the Kaluza-Klein spectrum. We comment on the agreement between our results and expectations based on the AdS/CFT correspondence, in particular logarithmic sensitivity to the 4D Planck scale.

  19. Study of the systematic errors in the calculation of renormalization constants of the topological susceptibility on the lattice

    CERN Document Server

    Allès, B; Di Giacomo, Adriano; Pica, C

    2005-01-01

    We present a study of the systematic effects in the nonperturbative evaluation of the renormalization constants which appear in the field-theoretical determination of the topological susceptibility in pure Yang-Mills theory. The study is performed by computing the renormalization constants on configurations that have been calibrated by use of the Ginsparg-Wilson formalism and by cooling.

  20. Coupling constant in dispersive model

    Indian Academy of Sciences (India)

    R Saleh-Moghaddam; M E Zomorrodian

    2013-11-01

    The average of the moments for event shapes in + - → hadrons within the context of next-to-leading order (NLO) perturbative QCD prediction in dispersive model is studied. Moments used in this article are $\\langle 1 - T \\rangle, \\langle ρ \\rangle, \\langle B_{T} \\rangle$ and $\\langle B_{W} \\rangle$. We extract , the coupling constant in perturbative theory and α0 in the non-perturbative theory using the dispersive model. By fitting the experimental data, the values of $(M_{Z^{°}})$ = 0.1171 ± 0.00229 and 0 ($_{I} = 2{\\text{GeV}}$) = 0.5068 ± 0.0440 are found. Our results are consistent with the above model. Our results are also consistent with those obtained from other experiments at different energies. All these features are explained in this paper.

  1. Scaling in landscape erosion: Renormalization group analysis of a model with infinitely many couplings

    Science.gov (United States)

    Antonov, N. V.; Kakin, P. I.

    2017-02-01

    Applying the standard field theory renormalization group to the model of landscape erosion introduced by Pastor-Satorras and Rothman yields unexpected results: the model is multiplicatively renormalizable only if it involves infinitely many coupling constants (i.e., the corresponding renormalization group equations involve infinitely many β-functions). We show that the one-loop counterterm can nevertheless be expressed in terms of a known function V (h) in the original stochastic equation and its derivatives with respect to the height field h. Its Taylor expansion yields the full infinite set of the one-loop renormalization constants, β-functions, and anomalous dimensions. Instead of a set of fixed points, there arises a two-dimensional surface of fixed points that quite probably contains infrared attractive regions. If that is the case, then the model exhibits scaling behavior in the infrared range. The corresponding critical exponents turn out to be nonuniversal because they depend on the coordinates of the fixed point on the surface, but they satisfy certain universal exact relations.

  2. Egalitarian Improvement to Democracy: Quark renormalization constants in N_f=2 QCD

    CERN Document Server

    Petrov, K

    2010-01-01

    We present our results on the non-perturbative evaluation of the renormalization constant for the quark field, $Z_q$, in Landau gauge within RI-MOM scheme. Using three lattice spacing we are able to isolate lattice artefacts of various origin, both perturbative and non-perturbative. In particular, the existence of the dimension-two gluon-condensate is discussed, and confirmed.

  3. Non-perturbative running of renormalization constants from correlators in coordinate space using step scaling

    CERN Document Server

    Cichy, Krzysztof; Korcyl, Piotr

    2016-01-01

    Working in a quenched setup with Wilson twisted mass valence fermions, we explore the possibility to compute non-perturbatively the step scaling function using the coordinate (X-space) renormalization scheme. This scheme has the advantage of being on-shell and gauge invariant. The step scaling method allows us to calculate the running of the renormalization constants of quark bilinear operators. We describe here the details of this calculation. The aim of this exploratory study is to identify the feasibility of the X-space scheme when used in small volume simulations required by the step scaling technique. Eventually, we translate our final results to the continuum MSbar scheme and compare against four-loop analytic formulae finding satisfactory agreement.

  4. Non-perturbative running of renormalization constants from correlators in coordinate space using step scaling

    Science.gov (United States)

    Cichy, Krzysztof; Jansen, Karl; Korcyl, Piotr

    2016-12-01

    Working in a quenched setup with Wilson twisted mass valence fermions, we explore the possibility to compute non-perturbatively the step scaling function using the coordinate (X-space) renormalization scheme. This scheme has the advantage of being on-shell and gauge invariant. The step scaling method allows us to calculate the running of the renormalization constants of quark bilinear operators. We describe here the details of this calculation. The aim of this exploratory study is to identify the feasibility of the X-space scheme when used in small volume simulations required by the step scaling technique. Eventually, we translate our final results to the continuum MS ‾ scheme and compare against four-loop analytic formulae finding satisfactory agreement.

  5. Analysis of systematic errors in the calculation of renormalization constants of the topological susceptibility on the lattice

    CERN Document Server

    Allès, B; Di Giacomo, Adriano; Pica, C

    2006-01-01

    A Ginsparg-Wilson based calibration of the topological charge is used to calculate the renormalization constants which appear in the field-theoretical determination of the topological susceptibility on the lattice. A systematic comparison is made with calculations based on cooling. The two methods agree within present statistical errors (3%-4%). We also discuss the independence of the multiplicative renormalization constant Z from the background topological charge used to determine it.

  6. Cosmological constant problem and renormalized vacuum energy density in curved background

    Science.gov (United States)

    Kohri, Kazunori; Matsui, Hiroki

    2017-06-01

    The current vacuum energy density observed as dark energy ρdarksimeq 2.5×10-47 GeV4 is unacceptably small compared with any other scales. Therefore, we encounter serious fine-tuning problem and theoretical difficulty to derive the dark energy. However, the theoretically attractive scenario has been proposed and discussed in literature: in terms of the renormalization-group (RG) running of the cosmological constant, the vacuum energy density can be expressed as ρvacuumsimeq m2H2 where m is the mass of the scalar field and rather dynamical in curved spacetime. However, there has been no rigorous proof to derive this expression and there are some criticisms about the physical interpretation of the RG running cosmological constant. In the present paper, we revisit the RG running effects of the cosmological constant and investigate the renormalized vacuum energy density in curved spacetime. We demonstrate that the vacuum energy density described by ρvacuumsimeq m2H2 appears as quantum effects of the curved background rather than the running effects of cosmological constant. Comparing to cosmological observational data, we obtain an upper bound on the mass of the scalar fields to be smaller than the Planck mass, m lesssim MPl.

  7. A new scheme for the running coupling constant in gauge theories using Wilson loops

    Energy Technology Data Exchange (ETDEWEB)

    Kurachi, Masafumi [Los Alamos National Laboratory; Bilgici, Erek [AUSTRIA; Flachi, Antonion [KYOTO UNIV; Itou, Etsuko [KOGAKUIN UNIV; David Lin, C J [NATIONAL CHIAO-TUNG UNIV; Matsufuru, Hideo [KEK; Ohki, Hiroshi [KYOTO UNIV; Onogi, Tetsuya [KYOTO UNIV; Yamazaki, Takeshi [UNIV OF TSUKUBA

    2009-01-01

    We propose a new renormalization scheme of the running coupling constant in general gauge theories defined by using the Wilson loops. The renormalized coupling constant is obtained from the Cretz ratio in lattice simulations and the corresponding perturbative coefficient at the leading order. The latter calculation is performed by adopting the zeta-function resummation techniques. We make a benchmark test of our scheme in quenched QCD with the plaquette gauge action. The running of the coupling constant is determined by applying the step scaling procedure. Using several methods to improve the statistical accuracy, we show that the running coupling constant can be determined in a wide range of energy scales with relatively small number of gauge configurations.

  8. The Determination of the Strong Coupling Constant

    Science.gov (United States)

    Dissertori, Günther

    2016-10-01

    The strong coupling constant is one of the fundamental parameters of the Standard Theory of particle physics. In this review I will briefly summarise the theoretical framework, within which the strong coupling constant is defined and how it is connected to measurable observables. Then I will give an historical overview of its experimental determinations and discuss the current status and world average value. Among the many different techniques used to determine this coupling constant in the context of quantum chromodynamics, I will focus in particular on a number of measurements carried out at the Large Electron-Positron Collider (LEP) and the Large Hadron Collider (LHC) at CERN.

  9. RNA structure and scalar coupling constants

    Energy Technology Data Exchange (ETDEWEB)

    Tinoco, I. Jr.; Cai, Z.; Hines, J.V.; Landry, S.M.; SantaLucia, J. Jr.; Shen, L.X.; Varani, G. [Univ. of California, Berkeley, CA (United States)

    1994-12-01

    Signs and magnitudes of scalar coupling constants-spin-spin splittings-comprise a very large amount of data that can be used to establish the conformations of RNA molecules. Proton-proton and proton-phosphorus splittings have been used the most, but the availability of {sup 13}C-and {sup 15}N-labeled molecules allow many more coupling constants to be used for determining conformation. We will systematically consider the torsion angles that characterize a nucleotide unit and the coupling constants that depend on the values of these torsion angles. Karplus-type equations have been established relating many three-bond coupling constants to torsion angles. However, one- and two-bond coupling constants can also depend on conformation. Serianni and coworkers measured carbon-proton coupling constants in ribonucleosides and have calculated their values as a function of conformation. The signs of two-bond coupling can be very useful because it is easier to measure a sign than an accurate magnitude.

  10. Renormalized energy of ground and first excited state of Fröhlich polaron in the range of weak coupling

    Directory of Open Access Journals (Sweden)

    M.V. Tkach

    2015-09-01

    Full Text Available The partial summing of infinite range of diagrams for the two-phonon mass operator of polaron described by Frohlich Hamiltonian is performed using the Feynman-Pines diagram technique. The renormalized spectral parameters of ground and first excited (phonon repeat polaron state are accurately calculated for the weak electron-phonon coupling at T=0 K. It is shown that the stronger electron-phonon interaction shifts the energy of both states into low-energy region of the spectra. The ground state stays stationary and the excited one - decays at bigger coupling constant.

  11. A new method of calculating the running coupling constant --- theoretical formulation ---

    CERN Document Server

    Bilgici, E; Itou, E; Kurachi, M; Lin, C -J D; Matsufuru, H; Ohki, H; Onogi, T; Yamazaki, T

    2008-01-01

    We propose a new method to compute the running coupling constant of gauge theories on the lattice. We first give the definition of the running coupling in the new scheme using the Wilson loops in a finite volume, and explain how the running of the coupling constant is extracted from the measurement of the volume dependence. The perturbative calculation of the renormalization constant to define the scheme is also given at the leading order. As a benchmark test of the new scheme we apply the method the case of the quenched QCD. We show the preliminary result from our numerical simulations which are carried out with plaquette gauge action for various lattice sizes and bare lattice couplings. With techniques to improve the statistical accuracy, we show that we can determine the non-perturbative running of the coupling constant in a wide range of the energy scale with relatively small number of gauge configurations in our scheme. We compare our lattice data of the running coupling constant with perturbative renorm...

  12. Standard-model coupling constants from compositeness

    CERN Document Server

    Besprosvany, J

    2003-01-01

    A coupling-constant definition is given based on the compositeness property of some particle states with respect to the elementary states of other particles. It is applied in the context of the vector-spin-1/2-particle interaction vertices of a field theory, and the standard model. The definition reproduces Weinberg's angle in a grand-unified theory. One obtains coupling values close to the experimental ones for appropriate configurations of the standard-model vector particles, at the unification scale within grand-unified models, and at the electroweak breaking scale.

  13. String coupling constant seems to be 1

    CERN Document Server

    Yoon, Youngsub

    2016-01-01

    We present a reasoning that the string coupling constant should be 1 from the assumption that the area spectrum derived from loop quantum gravity must be equal to the area spectrum calculated from "stringy differential geometry." To this end, we will use the loop quantum gravity area spectrum constructions proposed by Brian Kong and us, and stringy differential geometry based on double field theory recently proposed by Imtak Jeon, Kanghoon Lee and Jeong-Hyuck Park.

  14. Nonminimal coupling and the cosmological constant problem

    CERN Document Server

    Glavan, Dražen

    2015-01-01

    We consider a universe with a positive effective cosmological constant and a nonminimally coupled scalar field. When the coupling constant is negative, the scalar field exhibits linear growth at asymptotically late times, resulting in a decaying effective cosmological constant. The Hubble rate in the Jordan frame reaches a self-similar solution, $H=1/(\\epsilon t)$, where the principal slow roll parameter $\\epsilon$ depends on $\\xi$, reaching maximally $\\epsilon=2$ (radiation era scaling) in the limit when $\\xi\\rightarrow -\\infty$. Similar results are found in the Einstein frame (E), with $H_E=1/(\\epsilon_E t)$, but now $\\epsilon_E \\rightarrow 4/3$ as $\\xi\\rightarrow -\\infty$. Therefore in the presence of a nonminimally coupled scalar de Sitter is not any more an attractor, but instead (when $\\xi4/3$ at a rate $\\Gamma\\gg H$, the scaling changes to that of matter, $\\epsilon\\rightarrow \\epsilon_m$, and the energy density in the effective cosmological becomes a fixed fraction of the matter energy density, $M_{\\rm...

  15. Hyperfine Coupling Constants from Internally Contracted Multireference Perturbation Theory.

    Science.gov (United States)

    Shiozaki, Toru; Yanai, Takeshi

    2016-09-13

    We present an accurate method for calculating hyperfine coupling constants (HFCCs) based on the complete active space second-order perturbation theory (CASPT2) with full internal contraction. The HFCCs are computed as a first-order property using the relaxed CASPT2 spin-density matrix that takes into account orbital and configurational relaxation due to dynamical electron correlation. The first-order unrelaxed spin-density matrix is calculated from one- and two-body spin-free counterparts that are readily available in the CASPT2 nuclear gradient program [M. K. MacLeod and T. Shiozaki, J. Chem. Phys. 142, 051103 (2015)], whereas the second-order part is computed directly using the newly extended automatic code generator. The relaxation contribution is then calculated from the so-called Z-vectors that are available in the CASPT2 nuclear gradient program. Numerical results are presented for the CN and AlO radicals, for which the CASPT2 values are comparable (or, even superior in some cases) to the ones computed by the coupled-cluster and density matrix renormalization group methods. The HFCCs for the hexaaqua complexes with V(II), Cr(III), and Mn(II) are also presented to demonstrate the accuracy and efficiency of our code.

  16. Do Wormholes Fix the Coupling Constants?

    Science.gov (United States)

    Goradia, Shantilal

    2004-05-01

    If Newtonian gravitation is modified to use surface-to-surface separation between particles, it can have the strength of nuclear force between nucleons. This may be justified by possible existence of quantum wormholes in particles. All gravitational interactions would be between coupled wormholes, emitting 1/r graviton flux from their exit mouths as a function of the particle size, allowing the point-like treatment above. When the wormhole exit mouths are 1 Planck length apart, the resultant force is the known strong force coupling constant with an order of magnitude of 40 compared to the normal gravitational strength for nucleons. In addition to being mathematically simple, the above finding is consistent with observations of other coupling constants, Feynman's speculation of "transfusion" of two particles into spin 2 gravitons (published in 1962), Hawking radiation, big-bang theory abundance of quantum wormholes, wormhole theory fine-tuned by Kip S. Thorne and Matt Visser, and recent microscopic gravity measurements. It potentially leads to the holographic principle being promoted by Dr. G. t' Hooft, by naturally pointing out that the mass of the particles is proportional to their diameter squared.

  17. Renormalization constants of the lattice energy momentum tensor using the gradient flow

    CERN Document Server

    Capponi, Francesco; Patella, Agostino; Rago, Antonio

    2016-01-01

    We employ a new strategy for a non perturbative determination of the renormalized energy momentum tensor. The strategy is based on the definition of suitable lattice Ward identities probed by observables computed along the gradient flow. The new set of identities exhibits many interesting qualities, arising from the UV finiteness of flowed composite operators. In this paper we show how this method can be used to non perturbatively renormalize the energy momentum tensor for a SU(3) Yang-Mills theory, and report our numerical results.

  18. Strong coupling constant from the photon structure function

    Energy Technology Data Exchange (ETDEWEB)

    Albino, Simon; Klasen, Michael; Soeldner-Rembold, Stefan

    2003-06-01

    We extract the value of the strong coupling constant a, from a single-parameter pointlike fit to the photon structure function F{sub 2}{sup {gamma}} at large {xi} and Q{sup 2} and from a first five-parameter full (pointlike and hadronic) fit to the complete F{sub 2}{sup {gamma}} data set taken at PETRA, TRISTAN, and LEP. In next-to-leading order and the MS renormalization and factorization schemes, we obtain {alpha}{sub s}(m{sub z}) = 0.1183 {+-} 0.0050(exp.){sub -0.0028}{sup +0.0029}(theor.) [pointlike] and {alpha}{sub s}(m{sub z}) = 0.1198 {+-} 0.0028(exp.){sub -0.0046}{sup +0.0034}(theor.) [pointlike and hadronic]. We demonstrate that the data taken at LEP have reduced the experimental error by about a factor of two, so that a competitive determination of {alpha}{sub s} from F{sub 2}{sup {gamma}} is now possible.

  19. Strong coupling constant from the photon structure function

    Energy Technology Data Exchange (ETDEWEB)

    Albino, S.; Klasen, M. [Hamburg Univ. (Germany). 2. Inst. fuer Theoretische Physik; Soeldner-Rembold, S. [Fermi National Accelerator Lab., Batavia, IL (United States)

    2002-05-01

    We extract the value of the strong coupling constant {alpha}{sub s} from a single-parameter pointlike fit to the photon structure function F{sub 2}{sup {gamma}} at large x and Q{sup 2} and from a first five-parameter full (pointlike and hadronic) fit to the complete F{sub 2}{sup {gamma}} data set taken at PETRA, TRISTAN, and LEP. In next-to-leading order and the MS renormalization and factorization schemes, we obtain {alpha}{sub s}(m{sub Z})=0.1183{+-}0.0050(exp.){sub -0.0028}{sup +0.0029}(theor.) [pointlike] and {alpha}{sub s}(m{sub Z})=0.1198{+-}0.0028(exp.){sub -0.0046}{sup +0.0034}(theor.) [pointlike and hadronic]. We demonstrate that the data taken at LEP have reduced the experimental error by about a factor of two, so that a competitive determination of {alpha}{sub s} from F{sub 2}{sup {gamma}} is now possible. (orig.)

  20. Perturbative subtraction of lattice artifacts in the computation of renormalization constants

    CERN Document Server

    Constantinou, M; Gockeler, M; Horsley, R; Panagopoulos, H; Perlt, H; Rakow, P E L; Schierholz, G; Schiller, A

    2012-01-01

    The determination of renormalization factors is of crucial importance. They relate the observables obtained on finite, discrete lattices to their measured counterparts in the continuum in a suitable renormalization scheme. Therefore, they have to be computed as precisely as possible. A widely used approach is the nonperturbative Rome-Southampton method. It requires, however, a careful treatment of lattice artifacts. They are always present because simulations are done at lattice spacings $a$ and momenta $p$ with $ap$ not necessarily small. In this paper we try to suppress these artifacts by subtraction of one-loop contributions in lattice perturbation theory. We compare results obtained from a complete one-loop subtraction with those calculated for a subtraction of $O(a^2)$.

  1. Symmetry breakdown and coupling constants of leptons

    Directory of Open Access Journals (Sweden)

    Gil C. Marques

    2007-06-01

    Full Text Available Based on a new approach to symmetries of the fundamental interactions we deal, in this paper, with the electroweak interactions of leptons. We show that the coupling constants, arising in the way leptons are coupled to intermediate bosons, can be understood as parameters associated to the breakdown of SU(2 and parity symmetries. The breakdown of both symmetries is characterized by a new parameter (the asymetry parameter of the electroweak interactions. This parameter gives a measure of the strength of breakdown of symmetries. We analyse the behaviour of the theory for three values of this parameter. The most relevant value is the one for which only the electromagnetic interactions do not break parity (the maximally allowed left-right asymetric theory. Maximamally allowed parity asymmetry is a requirement that is met for a value of Weinberg's theta-angle that is quite close to the experimental value of this parameter.Com base em uma formulação nova para simetrias das interações fundamentais nós lidamos, neste trabalho, com interações eletrofracas de leptons. Mostramos que as constantes do acoplamento, associadas aos acoplamentos de bósons intermediários, podem ser entendidas como parâmetros associados à quebra de simetrias SU(2 e paridade. A quebra de ambas as simetrias é caracterizada por um parâmetro novo (o parâmetro de assimetria das interações eletrofracas. Este parâmetro dá uma medida da intensidade com que a simetria é quebrada. Analisamos o comportamento da teoria para três valores deste parâmetro. O valor mais relevante é aquele para o qual apenas as interações eletromagnéticas não quebram a paridade (a teoria assimétrica esquerda-direita permitida da maneira máxima. A assimetria máxima permitida é uma exigência que leva a um ângulo de Weinberg cujo valor é próximo daquele observado experimentalmente.

  2. Influence of coupling constants on nuclear symmetry energy

    Institute of Scientific and Technical Information of China (English)

    LIU Bei-Bei; OUYANG Fei; CHEN Wei

    2013-01-01

    By studying the energy of neutron star matter,we discuss the nuclear symmetry energy at different baryon densities and different coupling constants in the relativistic mean field approximation.The results show that the symmetry energy increases with baryon density at various coupling constants and incompressibilities.Furthermore,the symmetry energy at saturation density increases with increasing incompressibility at fixed d,and decreases at fixed c.Specifically,when coupling constants gv and gs are fixed,respectively,the symmetry energy has a little change with increasing incompressibility.It is demonstrated that the NN coupling constants have greater influences on the symmetry energy than the self-coupling constants.

  3. Ab initio density matrix renormalization group study of magnetic coupling in dinuclear iron and chromium complexes

    Energy Technology Data Exchange (ETDEWEB)

    Harris, Travis V.; Morokuma, Keiji, E-mail: morokuma@fukui.kyoto-u.ac.jp [Fukui Institute for Fundamental Chemistry, Kyoto University, Kyoto 606-8103 (Japan); Kurashige, Yuki; Yanai, Takeshi [Institute for Molecular Science, 38 Nishigo-Naka, Myodaiji, Okazaki 444-8585 (Japan)

    2014-02-07

    The applicability of ab initio multireference wavefunction-based methods to the study of magnetic complexes has been restricted by the quickly rising active-space requirements of oligonuclear systems and dinuclear complexes with S > 1 spin centers. Ab initio density matrix renormalization group (DMRG) methods built upon an efficient parameterization of the correlation network enable the use of much larger active spaces, and therefore may offer a way forward. Here, we apply DMRG-CASSCF to the dinuclear complexes [Fe{sub 2}OCl{sub 6}]{sup 2−} and [Cr{sub 2}O(NH{sub 3}){sub 10}]{sup 4+}. After developing the methodology through systematic basis set and DMRG M testing, we explore the effects of extended active spaces that are beyond the limit of conventional methods. We find that DMRG-CASSCF with active spaces including the metal d orbitals, occupied bridging-ligand orbitals, and their virtual double shells already capture a major portion of the dynamic correlation effects, accurately reproducing the experimental magnetic coupling constant (J) of [Fe{sub 2}OCl{sub 6}]{sup 2−} with (16e,26o), and considerably improving the smaller active space results for [Cr{sub 2}O(NH{sub 3}){sub 10}]{sup 4+} with (12e,32o). For comparison, we perform conventional MRCI+Q calculations and find the J values to be consistent with those from DMRG-CASSCF. In contrast to previous studies, the higher spin states of the two systems show similar deviations from the Heisenberg spectrum, regardless of the computational method.

  4. Temporal variation of coupling constants and nucleosynthesis

    CERN Document Server

    Oberhummer, Heinz; Fairbairn, M; Schlattl, H; Sharma, M M

    2003-01-01

    We investigate the triple-alpha process and the Oklo phenomenon to obtain constraints on possible cosmological time variations of fundamental constants. Specifically we study cosmological temporal constraints for the fine structure constant and nucleon and meson masses.

  5. Temporal variation of coupling constants and nucleosynthesis

    Science.gov (United States)

    Oberhummer, H.; Csótó, A.; Fairbairn, M.; Schlattl, H.; Sharma, M. M.

    2003-05-01

    We investigate the triple-alpha process and the Oklo phenomenon to obtain constraints on possible cosmological time variations of fundamental constants. Specifically we study cosmological temporal constraints for the fine structure constant and nucleon and meson masses.

  6. A regularized and renormalized electrostatic coupling Hamiltonian for hybrid quantum-mechanical-molecular-mechanical calculations.

    Science.gov (United States)

    Biswas, P K; Gogonea, V

    2005-10-22

    We describe a regularized and renormalized electrostatic coupling Hamiltonian for hybrid quantum-mechanical (QM)-molecular-mechanical (MM) calculations. To remedy the nonphysical QM/MM Coulomb interaction at short distances arising from a point electrostatic potential (ESP) charge of the MM atom and also to accommodate the effect of polarized MM atom in the coupling Hamiltonian, we propose a partial-wave expansion of the ESP charge and describe the effect of a s-wave expansion, extended over the covalent radius r(c), of the MM atom. The resulting potential describes that, at short distances, large scale cancellation of Coulomb interaction arises intrinsically from the localized expansion of the MM point charge and the potential self-consistently reduces to 1r(c) at zero distance providing a renormalization to the Coulomb energy near interatomic separations. Employing this renormalized Hamiltonian, we developed an interface between the Car-Parrinello molecular-dynamics program and the classical molecular-dynamics simulation program Groningen machine for chemical simulations. With this hybrid code we performed QM/MM calculations on water dimer, imidazole carbon monoxide (CO) complex, and imidazole-heme-CO complex with CO interacting with another imidazole. The QM/MM results are in excellent agreement with experimental data for the geometry of these complexes and other computational data found in literature.

  7. Differential Renormalization, the Action Principle and Renormalization Group Calculations

    OpenAIRE

    Smirnov, V. A.

    1994-01-01

    General prescriptions of differential renormalization are presented. It is shown that renormalization group functions are straightforwardly expressed through some constants that naturally arise within this approach. The status of the action principle in the framework of differential renormalization is discussed.

  8. Renormalizing coupled scalars with a momentum dependent mixing angle in the MSSM

    CERN Document Server

    Díaz, M A

    1994-01-01

    The renormalization of a system of coupled scalars fields is analyzed. By introducing a momentum dependent mixing angle we diagonalize the inverse propagator matrix at any momentum p^2. The zeros of the inverse propagator matrix, \\ie, the physical masses, are then calculated keeping the full momentum dependence of the self energies. The relation between this method and others previously published is studied. This idea is applied to the one-loop renormalization of the CP-even neutral Higgs sector of the Minimal Supersymmetric Model, considering top and bottom quarks and squarks in the loops. Presented in the Eighth Meeting of the Division of Particles and Fields of the American Physical Society ``DPF'94'', The University of New Mexico Albuquerque NM, August 2-6, 1994.

  9. Entanglement Entropy Renormalization for the NC scalar field coupled to classical BTZ geometry

    CERN Document Server

    Jurić, Tajron

    2016-01-01

    In this work, we consider a noncommutative (NC) massless scalar field coupled to the classical nonrotational BTZ geometry. In a manner of the theories where the gravity emerges from the underlying scalar field theory, we study the effective action and the entropy derived from this noncommutative model. In particular, the entropy is calculated by making use of the two different approaches, the brick wall method and the heat kernel method designed for spaces with conical singularity. We show that the UV divergent structures of the entropy, obtained through these two different methods, agree with each other. It is also shown that the same renormalization condition that removes the infinities from the effective action can also be used to renormalize the entanglement entropy for the same system. Besides, the interesting feature of the NC model considered here is that it allows an interpretation in terms of an equivalent system comprising of a commutative massive scalar field, but in a modified geometry; that of th...

  10. Phenomenological theory of a renormalized simplified model based on time-convolutionless mode-coupling theory near the glass transition

    Science.gov (United States)

    Tokuyama, Michio

    2017-01-01

    The renormalized simplified model is proposed to investigate indirectly how the static structure factor plays an important role in renormalizing a quadratic nonlinear term in the ideal mode-coupling memory function near the glass transition. The renormalized simplified recursion equation is then derived based on the time-convolutionless mode-coupling theory (TMCT) proposed recently by the present author. This phenomenological approach is successfully applied to check from a unified point of view how strong liquids are different from fragile liquids. The simulation results for those two types of liquids are analyzed consistently by the numerical solutions of the recursion equation. Then, the control parameter dependence of the renormalized nonlinear exponent in both types of liquids is fully investigated. Thus, it is shown that there exists a novel difference between the universal behavior in strong liquids and that in fragile liquids not only for their transport coefficients but also for their dynamics.

  11. Renormalization and causality violations in classical gravity coupled with quantum matter

    Energy Technology Data Exchange (ETDEWEB)

    Anselmi, Damiano [Dipartimento di Fisica ' Enrico Fermi' , Universita di Pisa, Largo Pontecorvo 3, I-56127 Pisa (Italy); INFN, Sezione di Pisa, Pisa (Italy)

    2007-01-15

    I prove that classical gravity coupled with quantized matter can be renormalized with a finite number of independent couplings, plus field redefinitions, without introducing higher-derivative kinetic terms in the gravitational sector, but adding vertices that couple the matter stress-tensor with the Ricci tensor. The theory is called 'acausal gravity', because it predicts the violation of causality at high energies. Renormalizability is proved by means of a map M that relates acausal gravity with higher-derivative gravity. The causality violations are governed by two parameters, a and b, that are mapped by M into higher-derivative couplings. At the tree level causal prescriptions exist, but they are spoiled by the one-loop corrections. Some ideas are inspired by the usual treatments of the Abraham-Lorentz force in classical electrodynamics.

  12. Renormalization Scheme Dependence and Renormalization Group Summation

    CERN Document Server

    McKeon, D G C

    2016-01-01

    We consider logarithmic contributions to the free energy, instanton effective action and Laplace sum rules in QCD that are a consequence of radiative corrections. Upon summing these contributions by using the renormalization group, all dependence on the renormalization scale parameter mu cancels. The renormalization scheme dependence in these processes is examined, and a renormalization scheme is found in which the effect of higher order radiative corrections is absorbed by the behaviour of the running coupling.

  13. Inflation from cosmological constant and nonminimally coupled scalar

    NARCIS (Netherlands)

    Glavan, Drazen; Marunovic, Anja; Prokopec, Tom

    2015-01-01

    We consider inflation in a universe with a positive cosmological constant and a nonminimally coupled scalar field, in which the field couples both quadratically and quartically to the Ricci scalar. When considered in the Einstein frame and when the nonminimal couplings are negative, the field starts

  14. Renormalization Scheme Dependence and the Renormalization Group Beta Function

    OpenAIRE

    Chishtie, F. A.; McKeon, D. G. C.

    2016-01-01

    The renormalization that relates a coupling "a" associated with a distinct renormalization group beta function in a given theory is considered. Dimensional regularization and mass independent renormalization schemes are used in this discussion. It is shown how the renormalization $a^*=a+x_2a^2$ is related to a change in the mass scale $\\mu$ that is induced by renormalization. It is argued that the infrared fixed point is to be a determined in a renormalization scheme in which the series expan...

  15. Experimental determination of the effective strong coupling constant

    Energy Technology Data Exchange (ETDEWEB)

    Alexandre Deur; Volker Burkert; Jian-Ping Chen; Wolfgang Korsch

    2007-07-01

    We extract an effective strong coupling constant from low Q{sup 2} data on the Bjorken sum. Using sum rules, we establish its Q{sup 2}-behavior over the complete Q{sup 2}-range. The result is compared to effective coupling constants extracted from different processes and to calculations based on Schwinger-Dyson equations, hadron spectroscopy or lattice QCD. Although the connection between the experimentally extracted effective coupling constant and the calculations is not clear, the results agree surprisingly well.

  16. Renormalization aspects of N=1 Super Yang-Mills theory in the Wess-Zumino gauge

    CERN Document Server

    Capri, M A L; Guimaraes, M S; Justo, I F; Mihaila, L; Sorella, S P; Vercauteren, D

    2014-01-01

    The renormalization of N=1 Super Yang-Mills theory is analysed in the Wess-Zumino gauge, employing the Landau condition. An all orders proof of the renormalizability of the theory is given by means of the Algebraic Renormalization procedure. Only three renormalization constants are needed, which can be identified with the coupling constant, gauge field and gluino renormalization. Moreover, due to the non-linear realization of the supersymmetry in the Wess-Zumino gauge, the renormalization factor of the gauge field turns out to be different from that of the gluino, as explicitly shown through a three loop calculation.

  17. Fermion field renormalization prescriptions

    OpenAIRE

    Zhou, Yong

    2005-01-01

    We discuss all possible fermion field renormalization prescriptions in conventional field renormalization meaning and mainly pay attention to the imaginary part of unstable fermion Field Renormalization Constants (FRC). We find that introducing the off-diagonal fermion FRC leads to the decay widths of physical processes $t\\to c Z$ and $b\\to s \\gamma$ gauge-parameter dependent. We also discuss the necessity of renormalizing the bare fields in conventional quantum field theory.

  18. Fisher's zeros as boundary of renormalization group flows in complex coupling spaces

    CERN Document Server

    Denbleyker, A; Liu, Yuzhi; Meurice, Y; Zou, Haiyuan

    2010-01-01

    We propose new methods to extend the renormalization group transformation to complex coupling spaces. We argue that the Fisher's zeros are located at the boundary of the complex basin of attraction of infra-red fixed points. We support this picture with numerical calculations at finite volume for two-dimensional O(N) models in the large-N limit and the hierarchical Ising model. We present numerical evidence that, as the volume increases, the Fisher's zeros of 4-dimensional pure gauge SU(2) lattice gauge theory with a Wilson action, stabilize at a distance larger than 0.15 from the real axis in the complex beta=4/g^2 plane. We discuss the implications for proofs of confinement and searches for nontrivial infra-red fixed points in models beyond the standard model.

  19. The thermal coupling constant and the gap equation in the {lambda}phi (cursive,open) Greek{sub D}{sup 4} model

    Energy Technology Data Exchange (ETDEWEB)

    Ananos, G.N.J. E-mail: gino@lafex.cbpf.br; Malbouisson, A.P.C. E-mail: adolfo@lafex.cbpf.bf; Svaiter, N.F. E-mail: nfuxsvai@lafex.cbpf.br

    1999-05-10

    By the concurrent use of two different resummation methods, the composite operator formalism and the Dyson-Schwinger equation, we re-examine the behavior at finite temperature of the O(N)-symmetric{lambda}phi (cursive,open) Greek{sup 4} model in a generic D-dimensional Euclidean space. In the cases D = 3 and D = 4, an analysis of the thermal behavior of the renormalized squared mass and coupling constant are carried out for all temperatures. It results that the thermal renormalized squared mass is positive and increases monotonically with the temperature. The behavior of the thermal coupling constant is quite different in odd- or even-dimensional space. In D = 3, the thermal coupling constant decreases up to a minimum value different from zero and then grows monotonically as the temperature increases. In the case D = 4, it is found that the thermal renormalized coupling constant tends, in the high-temperature limit, to a constant asymptotic value. Also for general D-dimensional Euclidean space, we are able to obtain a formula for the critical temperature of the second-order phase transition. This formula agrees with previous known values at D = 3 and D = 4.

  20. The thermal coupling constant and the gap equation in the lambda phi (cursive,open) Greek sub D sup 4 model

    CERN Document Server

    Ananos, G N J; Svaiter, N F

    1999-01-01

    By the concurrent use of two different resummation methods, the composite operator formalism and the Dyson-Schwinger equation, we re-examine the behavior at finite temperature of the O(N)-symmetric lambda phi (cursive,open) Greek sup 4 model in a generic D-dimensional Euclidean space. In the cases D = 3 and D = 4, an analysis of the thermal behavior of the renormalized squared mass and coupling constant are carried out for all temperatures. It results that the thermal renormalized squared mass is positive and increases monotonically with the temperature. The behavior of the thermal coupling constant is quite different in odd- or even-dimensional space. In D = 3, the thermal coupling constant decreases up to a minimum value different from zero and then grows monotonically as the temperature increases. In the case D = 4, it is found that the thermal renormalized coupling constant tends, in the high-temperature limit, to a constant asymptotic value. Also for general D-dimensional Euclidean space, we are able to ...

  1. Universal critical behavior of noisy coupled oscillators: a renormalization group study.

    Science.gov (United States)

    Risler, Thomas; Prost, Jacques; Jülicher, Frank

    2005-07-01

    We show that the synchronization transition of a large number of noisy coupled oscillators is an example for a dynamic critical point far from thermodynamic equilibrium. The universal behaviors of such critical oscillators, arranged on a lattice in a d -dimensional space and coupled by nearest-neighbors interactions, can be studied using field-theoretical methods. The field theory associated with the critical point of a homogeneous oscillatory instability (or Hopf bifurcation of coupled oscillators) is the complex Ginzburg-Landau equation with additive noise. We perform a perturbative renormalization group (RG) study in a (4-epsilon)-dimensional space. We develop an RG scheme that eliminates the phase and frequency of the oscillations using a scale-dependent oscillating reference frame. Within Callan-Symanzik's RG scheme to two-loop order in perturbation theory, we find that the RG fixed point is formally related to the one of the model A dynamics of the real Ginzburg-Landau theory with an O2 symmetry of the order parameter. Therefore, the dominant critical exponents for coupled oscillators are the same as for this equilibrium field theory. This formal connection with an equilibrium critical point imposes a relation between the correlation and response functions of coupled oscillators in the critical regime. Since the system operates far from thermodynamic equilibrium, a strong violation of the fluctuation-dissipation relation occurs and is characterized by a universal divergence of an effective temperature. The formal relation between critical oscillators and equilibrium critical points suggests that long-range phase order exists in critical oscillators above two dimensions.

  2. Coupling constant corrections in holographic heavy ion collisions

    CERN Document Server

    Grozdanov, Sašo

    2016-01-01

    We initiate a holographic study of coupling-dependent heavy ion collisions by analysing for the first time the effects of leading-order, inverse coupling constant corrections. In the dual description, this amounts to colliding gravitational shock waves in a theory with curvature-squared terms. We find that at intermediate coupling, nuclei experience less stopping and have more energy deposited near the lightcone. When the decreased coupling results in an 80% larger shear viscosity, the time at which hydrodynamics becomes a good description of the plasma created from high energy collisions increases by 25%. The hydrodynamic phase of the evolution starts with a wider rapidity profile and smaller entropy.

  3. A state interaction spin-orbit coupling density matrix renormalization group method

    Science.gov (United States)

    Sayfutyarova, Elvira R.; Chan, Garnet Kin-Lic

    2016-06-01

    We describe a state interaction spin-orbit (SISO) coupling method using density matrix renormalization group (DMRG) wavefunctions and the spin-orbit mean-field (SOMF) operator. We implement our DMRG-SISO scheme using a spin-adapted algorithm that computes transition density matrices between arbitrary matrix product states. To demonstrate the potential of the DMRG-SISO scheme we present accurate benchmark calculations for the zero-field splitting of the copper and gold atoms, comparing to earlier complete active space self-consistent-field and second-order complete active space perturbation theory results in the same basis. We also compute the effects of spin-orbit coupling on the spin-ladder of the iron-sulfur dimer complex [Fe2S2(SCH3)4]3-, determining the splitting of the lowest quartet and sextet states. We find that the magnitude of the zero-field splitting for the higher quartet and sextet states approaches a significant fraction of the Heisenberg exchange parameter.

  4. A state interaction spin-orbit coupling density matrix renormalization group method.

    Science.gov (United States)

    Sayfutyarova, Elvira R; Chan, Garnet Kin-Lic

    2016-06-21

    We describe a state interaction spin-orbit (SISO) coupling method using density matrix renormalization group (DMRG) wavefunctions and the spin-orbit mean-field (SOMF) operator. We implement our DMRG-SISO scheme using a spin-adapted algorithm that computes transition density matrices between arbitrary matrix product states. To demonstrate the potential of the DMRG-SISO scheme we present accurate benchmark calculations for the zero-field splitting of the copper and gold atoms, comparing to earlier complete active space self-consistent-field and second-order complete active space perturbation theory results in the same basis. We also compute the effects of spin-orbit coupling on the spin-ladder of the iron-sulfur dimer complex [Fe2S2(SCH3)4](3-), determining the splitting of the lowest quartet and sextet states. We find that the magnitude of the zero-field splitting for the higher quartet and sextet states approaches a significant fraction of the Heisenberg exchange parameter.

  5. Unification of coupling constants without a covering GUT

    Energy Technology Data Exchange (ETDEWEB)

    Theisen, S.; Zoupanos, G.; Tracas, D.

    1988-03-01

    We discuss the possibility of unification of gauge coupling constants of the standard model and its extensions at some high scale without the assumption of the existence of a covering GUT at that scale. In our analysis we examine (i) the standard model, (ii) its supersymmetric extension and (iii) an extension in which the spontaneous symmetry breaking is based on the condensation of high-colour fermions. The latter case is favoured for perturbative coupling constants unification while the supersymmetric extension of the standard model, with five families, is favoured for non-perturbative unification.

  6. Five-Loop Running of the QCD coupling constant

    CERN Document Server

    Baikov, P A; Kühn, J H

    2016-01-01

    We analytically compute the five-loop term in the beta function which governs the running of $\\alpha_s$ --- the quark-gluon coupling constant in QCD. The new term leads to a reduction of the theory uncertainty in $\\alpha_s$ taken at the Z-boson scale as extracted from the $\\tau$-lepton decays as well as to new, improved by one more order of perturbation theory, predictions for the effective coupling constants of the Standard Model Higgs boson to gluons and for its total decay rate to the quark-antiquark pairs.

  7. Nuclear magnetic resonance J coupling constant polarizabilities of hydrogen peroxide

    DEFF Research Database (Denmark)

    Kjær, Hanna; Nielsen, Monia R.; Pagola, Gabriel I.

    2012-01-01

    approximation for the small molecule hydrogen peroxide, which allowed us to carry out calculations with the largest available basis sets optimized for the calculation of NMR coupling constants. We ¿nd a systematic but rather slow convergence with the one-electron basis set and that augmentation functions...

  8. Local Correlation Calculations Using Standard and Renormalized Coupled-Cluster Methods

    Science.gov (United States)

    Piecuch, Piotr; Li, Wei; Gour, Jeffrey

    2009-03-01

    Local correlation variants of the coupled-cluster (CC) theory with singles and doubles (CCSD) and CC methods with singles, doubles, and non-iterative triples, including CCSD(T) and the completely renormalized CR-CC(2,3) approach, are developed. The main idea of the resulting CIM-CCSD, CIM-CCSD(T), and CIM-CR-CC(2,3) methods is the realization of the fact that the total correlation energy of a large system can be obtained as a sum of contributions from the occupied orthonormal localized molecular orbitals and their respective occupied and unoccupied orbital domains. The CIM-CCSD, CIM-CCSD(T), and CIM-CR-CC(2,3) algorithms are characterized by the linear scaling of the total CPU time with the system size and embarrassing parallelism. By comparing the results of the canonical and CIM-CC calculations for normal alkanes and water clusters, it is demonstrated that the CIM-CCSD, CIM-CCSD(T), and CIM-CR-CC(2,3) approaches recover the corresponding canonical CC correlation energies to within 0.1 % or so, while offering savings in the computer effort by orders of magnitude. By examining the dissociation of dodecane into C11H23 and CH3 and several lowest-energy structures of the (H2O)n clusters, it is shown that the CIM-CC methods accurately reproduce the relative energetics of the corresponding canonical CC calculations.

  9. Experimental test of renormalization group theory on the uniaxial, dipolar coupled ferromagnet LiTbf4

    DEFF Research Database (Denmark)

    Als-Nielsen, Jens Aage

    1976-01-01

    The transverse correlation range ξ and the susceptibility in the critical region has been measured by neutron scattering. A special technique required to resolve the superdiverging longitudinal correlation range has been utilized. The results for ξ together with existing specific-heat data are in...... are in remarkable agreement with the renormalization group theory of systems with marginal dimensionality. The ratio between the susceptibility amplitudes above and below Tc was found to be 2 in accordance with renormalization-group and meanfield theory....

  10. High-loop perturbative renormalization constants for Lattice QCD (II): three-loop quark currents for tree-level Symanzik improved gauge action and n_f=2 Wilson fermions

    CERN Document Server

    Brambilla, Michele

    2013-01-01

    Numerical Stochastic Perturbation Theory was able to get three- (and even four-) loop results for finite Lattice QCD renormalization constants. More recently, a conceptual and technical framework has been devised to tame finite size effects, which had been reported to be significant for (logarithmically) divergent renormalization constants. In this work we present three-loop results for fermion bilinears in the Lattice QCD regularization defined by tree-level Symanzik improved gauge action and n_f=2 Wilson fermions. We discuss both finite and divergent renormalization constants in the RI'-MOM scheme. Since renormalization conditions are defined in the chiral limit, our results also apply to Twisted Mass QCD, for which non-perturbative computations of the same quantities are available. We emphasize the importance of carefully accounting for both finite lattice space and finite volume effects. In our opinion the latter have in general not attracted the attention they would deserve.

  11. Charge renormalization and other exact coupling corrections to the dipolar effective interaction in an electrolyte near a dielectric wall.

    Science.gov (United States)

    Aqua, J-N; Cornu, F

    2004-11-01

    The aim of the paper is to study the renormalizations of the charge and screening length that appear in the large-distance behavior of the effective pairwise interaction w(alphaalpha') between two charges e(alpha) and e(alpha') in a dilute electrolyte solution, both along a dielectric wall and in the bulk. The electrolyte is described by the so-called primitive model in the framework of classical statistical mechanics and the electrostatic response of the wall is characterized by its dielectric constant. In a previous paper [Phys. Rev. E 68, 022133 (2003)] a graphic reorganization of resummed Mayer diagrammatics has been devised in order to exhibit the general structure of the 1/y3 leading tail of w(alphaalpha') (x,x',y) for two charges located at distances x and x' from the wall and separated by a distance y along the wall. When all species have the same closest approach distance b to the wall, the coefficient of the 1/y3 tail is the product Dalpha(x)Dalpha'(x') of two effective dipoles. Here we use the same graphic reorganization in order to systematically investigate the exponential large-distance behavior of w(alphaalpha') in the bulk. (We show that the reorganization also enables one to derive the basic screening rules in both cases.) Then, in a regime of high dilution and weak coupling, the exact analytical corrections to the leading tail of w(alphaalpha'), both in the bulk or along the wall, are calculated at first order in the coupling parameter epsilon and in the limit where b becomes negligible with respect to the Debye screening length. (Epsilon is proportional to the so-called plasma parameter.) The structure of corrections to the terms of order epsilon is exhibited, and the scaling regime for the validity of the Debye limit is specified. In the vicinity of the wall, we use the density profiles calculated previously [J. Stat. Phys. 105, 211 (2001)] up to order epsilon and a method devised [J. Stat. Phys. 105, 245 (2001)] for the determination of the

  12. The strong coupling constant in grand unified theories

    Energy Technology Data Exchange (ETDEWEB)

    Pierce, D.M.

    1997-01-01

    The prediction of the strong coupling constant in grand unified theories is reviewed, first in the standard model, then in the supersymmetric version. Various corrections are considered. The predictions in both supergravity-induced and gauge-mediated supersymmetry breaking models are discussed. In the region of parameter space without large fine tuning the strong coupling is predicted to be {alpha}{sub s} (M{sub Z}) {approx}> 0.13. Imposing {alpha}{sub s} (M{sub Z}) = 0.118, the authors require a unification scale threshold correction of typically -2%, which is accommodated by some GUT models but in conflict with others.

  13. Precise strength of the $\\pi$NN coupling constant

    CERN Document Server

    Ericson, Torleif Eric Oskar; Rahm, J; Blomgren, J; Olsson, N; Thomas, A W

    1998-01-01

    We report here a preliminary value for the piNN coupling constant deduced from the GMO sumrule for forward piN scattering. As in our previous determination from np backward differential scattering cross sections we give a critical discussion of the analysis with careful attention not only to the statistical, but also to the systematic uncertainties. Our preliminary evaluation gives $g^2_c$(GMO) = 13.99(24).

  14. The structure of renormalization Hopf algebras for gauge theories I: Representing Feynman graphs on BV-algebras

    OpenAIRE

    Suijlekom, W.D. van

    2008-01-01

    We study the structure of renormalization Hopf algebras of gauge theories. We identify certain Hopf subalgebras in them, whose character groups are semidirect products of invertible formal power series with formal diffeomorphisms. This can be understood physically as wave function renormalization and renormalization of the coupling constants, respectively. After taking into account the Slavnov-Taylor identities for the couplings as generators of a Hopf ideal, we find Hopf subalgebras in the c...

  15. Calculation of hyperfine coupling constant by symmetry adapted cluster expansion configuration interaction theory. II. Anisotropic constants

    Science.gov (United States)

    Momose, Takamasa; Yamaguchi, Makoto; Shida, Tadamasa

    1990-11-01

    Following the previous work on the isotropic hyperfine coupling constants (HFCCs) of polyatomic radicals the symmetry adapted cluster expansion-configuration interaction (SAC-CI) theory is applied to calculate anisotropic HFCCs also. The results are compared with available experimental data from diatomic to polyatomic radicals such as the vinoxy. For radicals consisting of only the first row atoms Dunning's double zeta (DZ) basis set is shown to be adequate, but for those containing the second row atoms inclusion of polarization functions is required. Compared with the isotropic HFCC the calculation of the anisotropic HFCC is less formidable. However, ignorance of electron correlation causes serious disagreements with experimental data.

  16. Study of the Strong Coupling Constant Using W+ Jet Processes

    Science.gov (United States)

    Abachi, S.; Abbott, B.; Abolins, M.; Acharya, B. S.; Adam, I.; Adams, D. L.; Adams, M.; Ahn, S.; Aihara, H.; Alitti, J.; Álvarez, G.; Alves, G. A.; Amidi, E.; Amos, N.; Anderson, E. W.; Aronson, S. H.; Astur, R.; Avery, R. E.; Baden, A.; Balamurali, V.; Balderston, J.; Baldin, B.; Bantly, J.; Bartlett, J. F.; Bazizi, K.; Bendich, J.; Beri, S. B.; Bertram, I.; Bezzubov, V. A.; Bhat, P. C.; Bhatnagar, V.; Bhattacharjee, M.; Bischoff, A.; Biswas, N.; Blazey, G.; Blessing, S.; Bloom, P.; Boehnlein, A.; Bojko, N. I.; Borcherding, F.; Borders, J.; Boswell, C.; Brandt, A.; Brock, R.; Bross, A.; Buchholz, D.; Burtovoi, V. S.; Butler, J. M.; Carvalho, W.; Casey, D.; Castilla-Valdez, H.; Chakraborty, D.; Chang, S.-M.; Chekulaev, S. V.; Chen, L.-P.; Chen, W.; Chevalier, L.; Chopra, S.; Choudhary, B. C.; Christenson, J. H.; Chung, M.; Claes, D.; Clark, A. R.; Cobau, W. G.; Cochran, J.; Cooper, W. E.; Cretsinger, C.; Cullen-Vidal, D.; Cummings, M. A.; Cutts, D.; Dahl, O. I.; de, K.; Demarteau, M.; Demina, R.; Denisenko, K.; Denisenko, N.; Denisov, D.; Denisov, S. P.; Dharmaratna, W.; Diehl, H. T.; Diesburg, M.; di Loreto, G.; Dixon, R.; Draper, P.; Drinkard, J.; Ducros, Y.; Dugad, S. R.; Durston-Johnson, S.; Edmunds, D.; Ellison, J.; Elvira, V. D.; Engelmann, R.; Eno, S.; Eppley, G.; Ermolov, P.; Eroshin, O. V.; Evdokimov, V. N.; Fahey, S.; Fahland, T.; Fatyga, M.; Fatyga, M. K.; Featherly, J.; Feher, S.; Fein, D.; Ferbel, T.; Finocchiaro, G.; Fisk, H. E.; Fisyak, Y.; Flattum, E.; Forden, G. E.; Fortner, M.; Frame, K. C.; Franzini, P.; Fuess, S.; Gallas, E.; Galyaev, A. N.; Gao, S. G.; Geld, T. L.; Genik, R. J., II; Genser, K.; Gerber, C. E.; Gibbard, B.; Glebov, V.; Glenn, S.; Gobbi, B.; Goforth, M.; Goldschmidt, A.; Gómez, B.; Goncharov, P. I.; González Solís, J. L.; Gordon, H.; Goss, L. T.; Graf, N.; Grannis, P. D.; Green, D. R.; Green, J.; Greenlee, H.; Griffin, G.; Grossman, N.; Grudberg, P.; Grünendahl, S.; Gu, W. X.; Guglielmo, G.; Guida, J. A.; Guida, J. M.; Guryn, W.; Gurzhiev, S. N.; Gutierrez, P.; Gutnikov, Y. E.; Hadley, N. J.; Haggerty, H.; Hagopian, S.; Hagopian, V.; Hahn, K. S.; Hall, R. E.; Hansen, S.; Hatcher, R.; Hauptman, J. M.; Hedin, D.; Heinson, A. P.; Heintz, U.; Hernández-Montoya, R.; Heuring, T.; Hirosky, R.; Hobbs, J. D.; Hoeneisen, B.; Hoftun, J. S.; Hsieh, F.; Hu, Tao; Hu, Ting; Hu, Tong; Huehn, T.; Igarashi, S.; Ito, A. S.; James, E.; Jaques, J.; Jerger, S. A.; Jiang, J. Z.-Y.; Joffe-Minor, T.; Johari, H.; Johns, K.; Johnson, M.; Johnstad, H.; Jonckheere, A.; Jones, M.; Jöstlein, H.; Jun, S. Y.; Jung, C. K.; Kahn, S.; Kalbfleisch, G.; Kang, J. S.; Kehoe, R.; Kelly, M. L.; Kernan, A.; Kerth, L.; Kim, C. L.; Kim, S. K.; Klatchko, A.; Klima, B.; Klochkov, B. I.; Klopfenstein, C.; Klyukhin, V. I.; Kochetkov, V. I.; Kohli, J. M.; Koltick, D.; Kostritskiy, A. V.; Kotcher, J.; Kourlas, J.; Kozelov, A. V.; Kozlovski, E. A.; Krishnaswamy, M. R.; Krzywdzinski, S.; Kunori, S.; Lami, S.; Landsberg, G.; Lebrat, J.-F.; Leflat, A.; Li, H.; Li, J.; Li, Y. K.; Li-Demarteau, Q. Z.; Lima, J. G.; Lincoln, D.; Linn, S. L.; Linnemann, J.; Lipton, R.; Liu, Y. C.; Lobkowicz, F.; Loken, S. C.; Lökös, S.; Lueking, L.; Lyon, A. L.; Maciel, A. K.; Madaras, R. J.; Madden, R.; Mandrichenko, I. V.; Mangeot, Ph.; Mani, S.; Mansoulié, B.; Mao, H. S.; Margulies, S.; Markeloff, R.; Markosky, L.; Marshall, T.; Martin, M. I.; Marx, M.; May, B.; Mayorov, A. A.; McCarthy, R.; McKibben, T.; McKinley, J.; McMahon, T.; Melanson, H. L.; de Mello Neto, J. R.; Merritt, K. W.; Miettinen, H.; Milder, A.; Mincer, A.; de Miranda, J. M.; Mishra, C. S.; Mohammadi-Baarmand, M.; Mokhov, N.; Mondal, N. K.; Montgomery, H. E.; Mooney, P.; Mudan, M.; Murphy, C.; Murphy, C. T.; Nang, F.; Narain, M.; Narasimham, V. S.; Narayanan, A.; Neal, H. A.; Negret, J. P.; Neis, E.; Nemethy, P.; NešiĆ, D.; Nicola, M.; Norman, D.; Oesch, L.; Oguri, V.; Oltman, E.; Oshima, N.; Owen, D.; Padley, P.; Pang, M.; Para, A.; Park, C. H.; Park, Y. M.; Partridge, R.; Parua, N.; Paterno, M.; Perkins, J.; Peryshkin, A.; Peters, M.; Piekarz, H.; Pischalnikov, Y.; Pluquet, A.; Podstavkov, V. M.; Pope, B. G.; Prosper, H. B.; Protopopescu, S.; Pušeljić, D.; Qian, J.; Quintas, P. Z.; Raja, R.; Rajagopalan, S.; Ramirez, O.; Rao, M. V.; Rapidis, P. A.; Rasmussen, L.; Read, A. L.; Reucroft, S.; Rijssenbeek, M.; Rockwell, T.; Roe, N. A.; Rubinov, P.; Ruchti, R.; Rusin, S.; Rutherfoord, J.; Santoro, A.; Sawyer, L.; Schamberger, R. D.; Schellman, H.; Sculli, J.; Shabalina, E.; Shaffer, C.; Shankar, H. C.; Shao, Y. Y.; Shivpuri, R. K.; Shupe, M.; Singh, J. B.; Sirotenko, V.; Smart, W.; Smith, A.; Smith, R. P.; Snihur, R.; Snow, G. R.; Snyder, S.; Solomon, J.; Sood, P. M.; Sosebee, M.; Souza, M.; Spadafora, A. L.; Stephens, R. W.; Stevenson, M. L.; Stewart, D.; Stoianova, D. A.; Stoker, D.; Streets, K.; Strovink, M.; Sznajder, A.; Taketani, A.; Tamburello, P.; Tarazi, J.; Tartaglia, M.; Taylor, T. L.; Teiger, J.; Thompson, J.; Trippe, T. G.; Tuts, P. M.; Varelas, N.; Varnes, E. W.; Virador, P. R.; Vititoe, D.; Volkov, A. A.; Vorobiev, A. P.; Wahl, H. D.; Wang, G.; Wang, J.; Warchol, J.; Wayne, M.; Weerts, H.; Wen, F.; Wenzel, W. A.; White, A.; White, J. T.; Wightman, J. A.; Wilcox, J.; Willis, S.; Wimpenny, S. J.; Wirjawan, J. V.; Womersley, J.; Won, E.; Wood, D. R.; Xu, H.; Yamada, R.; Yamin, P.; Yanagisawa, C.; Yang, J.; Yasuda, T.; Yoshikawa, C.; Youssef, S.; Yu, J.; Yu, Y.; Zhang, D. H.; Zhang, Y.; Zhu, Q.; Zhu, Z. H.; Zieminska, D.; Zieminski, A.; Zylberstejn, A.

    1995-10-01

    The ratio of the number of W+1 jet to W+0 jet events is measured with the D0 detector using data from the 1992-93 Tevatron Collider run. For the W-->eν channel with a minimum jet ET cutoff of 25 GeV, the experimental ratio is 0.065+/-0.003stat+/-0.007syst. Next-to-leading order QCD predictions for various parton distributions agree well with each other and are all over 1 standard deviation below the measurement. Varying the strong coupling constant αs in both the parton distributions and the partonic cross sections simultaneously does not remove this discrepancy.

  17. Algebraic renormalization of parity-preserving QED{sub 3} coupled to scalar matter I: unbroken case

    Energy Technology Data Exchange (ETDEWEB)

    Cima, O.M. del; Franco, D.H.T.; Helayel-Neto, J.A. [Centro Brasileiro de Pesquisas Fisicas (CBPF), Rio de Janeiro, RJ (Brazil); Piguet, O. [Universite de Geneve (Switzerland). Dept. de Physique Theorique

    1996-11-01

    In this letter the algebraic renormalization method, which is independent of any kind of regularization scheme, is presented for the parity-preserving QED{sub 3} coupled to scalar matter in the symmetric regime, where the scalar assumes vanishing vacuum expectation value,<{phi}>=0. The model shows to be stable under radiative corrections and anomaly free. (author). 17 refs.; e-mail: oswaldo at cbpfsu1.cat.cbpf.br; franco at cbpfsu1.cat.cbpf.br; piguet at sc2a.unige.ch.

  18. Assessment of zinc finger orientations by residual dipolar coupling constants

    Energy Technology Data Exchange (ETDEWEB)

    Tsui, Vickie; Zhu Leiming; Huang, T.-H.; Wright, Peter E.; Case, David A. [Scripps Research Institute, Department of Molecular Biology (United States)

    2000-01-15

    Residual dipolar coupling constants measured in anisotropic solution contain information on orientations between internuclear vectors and the magnetic field, providing long-range information that may help determine the relative orientations of distinct domains in biomolecules. Here we describe the measurement and use of residual dipolar coupling restraints in the refinement of the structure of the complex of DNA with three zinc fingers of transcription factor IIIA (TFIIIA), measured in a DMPC/DHPC bicelle solution. These dipolar restraints were applied on a variety of orientations of the zinc finger domains (derived from crystallography, previous NMR studies, and systematic modeling) in order to examine the validity and sensitivity of using residual dipolar splittings to study interdomain orientations. The spread in interdomain angles between zinc fingers is reduced from 24 deg. to 9 deg. upon incorporation of dipolar restraints. However, the results also show that the ability to determine relative orientations is strongly dependent on the structural accuracy of the local domain structures.

  19. Dynamical and anharmonic effects on the electron-phonon coupling and the zero-point renormalization of the band structure

    Science.gov (United States)

    Antonius, Gabriel; Poncé, Samuel; Lantagne-Hurtubise, Étienne; Auclair, Gabriel; Côté, Michel; Gonze, Xavier

    2015-03-01

    The electron-phonon coupling in solids renormalizes the band structure, reducing the band gap by several tenths of an eV in light-atoms semiconductors. Using the Allen-Heine-Cardona theory (AHC), we compute the zero-point renormalization (ZPR) as well as the quasiparticle lifetimes of the full band structure in diamond, BN, LiF and MgO. We show how dynamical effects can be included in the AHC theory, and still allow for the use of a Sternheimer equation to avoid the summation over unoccupied bands. The convergence properties of the electron-phonon coupling self-energy with respect to the Brillouin zone sampling prove to be strongly affected by dynamical effects. We complement our study with a frozen-phonon approach, which reproduces the static AHC theory, but also allows to probe the phonon wavefunctions at finite displacements and include anharmonic effects in the self-energy. We show that these high-order components tend to reduce the strongest electron-phonon coupling elements, which affects significantly the band gap ZPR.

  20. Renormalization group improved Higgs inflation with a running kinetic term

    Science.gov (United States)

    Takahashi, Fuminobu; Takahashi, Ryo

    2016-09-01

    We study a Higgs inflation model with a running kinetic term, taking account of the renormalization group evolution of relevant coupling constants. Specifically we study two types of the running kinetic Higgs inflation, where the inflaton potential is given by the quadratic or linear term potential in a frame where the Higgs field is canonically normalized. We solve the renormalization group equations at two-loop level and calculate the scalar spectral index and the tensor-to-scalar ratio. We find that, even if the renormalization group effects are included, the quadratic inflation is ruled out by the CMB observations, while the linear one is still allowed.

  1. Assessment of DFT functionals with fluorine-fluorine coupling constants

    Science.gov (United States)

    García de la Vega, J. M.; San Fabián, J.

    2015-07-01

    Density functional theory (DFT) calculations of nuclear magnetic resonance (NMR) spin-spin coupling constants (SSCCs) provide an important contribution for understanding experimentally observed values. It is known that calculated SSCCs using DFT methods correlate well with those experimentally measured. Unlike most of SSCCs, in fluorine compounds, fluorine-fluorine SSCC JFF shows that the Fermi contact (FC) term is not dominant, particularly for JFF in polyfluorinated organic molecules. In order to devise a DFT approach that would correctly reproduce the variation of SSCCs within a series of fluorine compounds, we test several DFT-based approaches, using different exchange and correlation functionals. Isotropic contributions to NMR fluorine-fluorine coupling constants (FC, spin-dipolar, SD, paramagnetic spin-orbit, PSO, and diamagnetic spin-orbit, DSO) have been calculated. Results show that DFT methods give appropriate values for nJFF (n = 4 to 7), while for geminal and vicinal JFF present large deviations from experimental values. For the latter SSCCs (2JFF and 3JFF), the four contributions (FC, SD, PSO and DSO) are analysed as a function of the local and nonlocal exchange in 1,1- and 1,2-difluoroethylene. Although FC term is not dominant for these SSCCs, the variation of this contribution with exchange is remarkable. On the other hand, SD and PSO contributions can be suitably computed without and with exact exchange, respectively. This article is dedicated to the memory of Prof. N. C. Handy, whose contributions to the development of Theoretical Chemistry have been widely recognized.

  2. On the electroweak contribution to the matching of the strong coupling constant in the SM

    Directory of Open Access Journals (Sweden)

    A.V. Bednyakov

    2015-02-01

    Full Text Available The effective renormalizable theory describing electromagnetic and strong interactions of quarks of five light flavors (nf=5 QCD×QED is considered as a low-energy limit of the full Standard Model. Two-loop relation between the running strong coupling constants αs defined in either theories is found by simultaneous decoupling of electroweak gauge and Higgs bosons in addition to the top-quark. The relation potentially allows one to confront “low-energy” determination of αs with a high-energy one with increased accuracy. Numerical impact of new O(αsα terms is studied at the MZ scale. It is shown that the corresponding contribution, although being suppressed with respect to O(αs2 terms, is an order of magnitude larger than the three-loop QCD corrections O(αs3 usually taken into account in four-loop renormalization group evolution of αs. The dependence on the matching scale is also analyzed numerically.

  3. Renormalized Effective QCD Hamiltonian Gluonic Sector

    CERN Document Server

    Robertson, D G; Szczepaniak, A P; Ji, C R; Cotanch, S R

    1999-01-01

    Extending previous QCD Hamiltonian studies, we present a new renormalization procedure which generates an effective Hamiltonian for the gluon sector. The formulation is in the Coulomb gauge where the QCD Hamiltonian is renormalizable and the Gribov problem can be resolved. We utilize elements of the Glazek and Wilson regularization method but now introduce a continuous cut-off procedure which eliminates non-local counterterms. The effective Hamiltonian is then derived to second order in the strong coupling constant. The resulting renormalized Hamiltonian provides a realistic starting point for approximate many-body calculations of hadronic properties for systems with explicit gluon degrees of freedom.

  4. Higher loop renormalization of fermion bilinear operators

    CERN Document Server

    Skouroupathis, A

    2007-01-01

    We compute the two-loop renormalization functions, in the RI' scheme, of local bilinear quark operators $\\bar\\psi\\Gamma\\psi$, where $\\Gamma$ denotes the Scalar and Pseudoscalar Dirac matrices, in the lattice formulation of QCD. We consider both the flavor non-singlet and singlet operators; the latter, in the scalar case, leads directly to the two-loop fermion mass renormalization, $Z_m$. As a prerequisite for the above, we also compute the quark field renormalization, $Z_\\psi$, up to two loops. We use the clover action for fermions and the Wilson action for gluons. Our results are given as a polynomial in $c_{SW}$, in terms of both the renormalized and bare coupling constant, in the renormalized Feynman gauge. We also confirm the 1-loop renormalization functions, for generic gauge. A longer write-up of the present work, including the conversion of our results to the MSbar scheme and a generalization to arbitrary fermion representations, can be found in arXiv:0707.2906 .

  5. Renormalization group and the deep structure of the proton

    CERN Document Server

    Petermann, Andreas

    1979-01-01

    The spirit of the renormalization group approach lies entirely in the observation that in a specific theory the renormalized constants such as the couplings, the masses, are arbitrary mathematical parameters which can be varied by changing arbitrarily the renormalization prescription. Given a scale of mass mu , prescriptions can be chosen by doing subtractions of the relevant amplitudes at the continuously varying points mu e/sup t/, t being an arbitrary real parameter. A representation of such a renormalization group transformation mu to mu + mu e/sup t/ is the transformation g to g(t) of the renormalized coupling into a continuously varying coupling constant, the so-called 'running coupling constant'. If, for the theory under investigation there exists a domain of the t space where g(t) is small, then because it is not known how to handle field theory beyond the perturbative approach attention must be focused on the experimental range in which the g(t) 'runs' with small values. The introduction of couplings...

  6. The properties of $C$-parameter and coupling constants

    Indian Academy of Sciences (India)

    R SALEH-MOGHADDAM; M E ZOMORRODIAN

    2017-01-01

    We present the properties of the C-parameter as an event-shape variable. We calculate the coupling constants in the perturbative and also in the non-perturbative parts of the QCD theory, using the dispersive as wellas the shape function models. By fitting the corresponding theoretical predictions to our data, we find $\\alpha_{s}(M_{Z^{0}} ) = 0.117 \\pm 0.014$ and $\\alpha_{0}(\\mu_{I} ) = 0.491 \\pm 0.043$ for dispersive model and $\\alpha_{ s}(M_{Z^{0}} ) = 0.124 \\pm 0.015$ and $\\lambda_{1} = 1.234 \\pm 0.052$ for the shape function model. Our results are consistent with the world average value of $\\alpha_{s}(M_{Z^{0}} ) = 0.118 \\pm 0.002$. All these features are explained in the main text.

  7. Relativistic extended coupled cluster method for magnetic hyperfine structure constant

    CERN Document Server

    Sasmal, Sudip; Nayak, Malaya K; Vaval, Nayana; Pal, Sourav

    2015-01-01

    This article deals with the general implementation of 4-component spinor relativistic extended coupled cluster (ECC) method to calculate first order property of atoms and molecules in their open-shell ground state configuration. The implemented relativistic ECC is employed to calculate hyperfine structure (HFS) constant of alkali metals (Li, Na, K, Rb and Cs), singly charged alkaline earth metal atoms (Be+, Mg+, Ca+ and Sr+) and molecules (BeH, MgF and CaH). We have compared our ECC results with the calculations based on restricted active space configuration interaction (RAS-CI) method. Our results are in better agreement with the available experimental values than those of the RAS-CI values.

  8. The GMO Sumrule and the πNN Coupling Constant

    Science.gov (United States)

    Ericson, T. E. O.; Loiseau, B.; Thomas, A. W.

    The isovector GMO sumrule for forward πN scattering is critically evaluated using the precise π-p and π-d scattering lengths obtained recently from pionic atom measurements. The charged πNN coupling constant is then deduced with careful analysis of systematic and statistical sources of uncertainties. This determination gives directly from data gc2(GMO)/4π = 14.17±0.09 (statistic) ±0.17 (systematic) or fc2/ 4π=0.078(11). This value is half-way between that of indirect methods (phase-shift analyses) and the direct evaluation from from backward np differential scattering cross sections (extrapolation to pion pole). From the π-p and π-d scattering lengths our analysis leads also to accurate values for (1/2)(aπ-p+aπ-n) and (1/2) (aπ-p-aπ-n).

  9. Renormalization of Polyakov loops in fundamental and higher representations

    CERN Document Server

    Kaczmarek, O; Hübner, K

    2007-01-01

    We compare two renormalization procedures, one based on the short distance behavior of heavy quark-antiquark free energies and the other by using bare Polyakov loops at different temporal entent of the lattice and find that both prescriptions are equivalent, resulting in renormalization constants that depend on the bare coupling. Furthermore these renormalization constants show Casimir scaling for higher representations of the Polyakov loops. The analysis of Polyakov loops in different representations of the color SU(3) group indicates that a simple perturbative inspired relation in terms of the quadratic Casimir operator is realized to a good approximation at temperatures $T \\gsim T_c$ for renormalized as well as bare loops. In contrast to a vanishing Polyakov loop in representations with non-zero triality in the confined phase, the adjoint loops are small but non-zero even for temperatures below the critical one. The adjoint quark-antiquark pairs exhibit screening. This behavior can be related to the bindin...

  10. Monte Carlo Simulation Calculation of Critical Coupling Constant for Continuum \\phi^4_2

    OpenAIRE

    Loinaz, Will; Willey, R. S.

    1997-01-01

    We perform a Monte Carlo simulation calculation of the critical coupling constant for the continuum {\\lambda \\over 4} \\phi^4_2 theory. The critical coupling constant we obtain is [{\\lambda \\over \\mu^2}]_crit=10.24(3).

  11. The strong coupling constant of QCD with four flavors

    Energy Technology Data Exchange (ETDEWEB)

    Tekin, Fatih

    2010-11-01

    In this thesis we study the theory of strong interaction Quantum Chromodynamics on a space-time lattice (lattice QCD) with four flavors of dynamical fermions by numerical simulations. In the early days of lattice QCD, only pure gauge field simulations were accessible to the computational facilities and the effects of quark polarization were neglected. The so-called fermion determinant in the path integral was set to one (quenched approximation). The reason for this approximation was mainly the limitation of computational power because the inclusion of the fermion determinant required an enormous numerical effort. However, for full QCD simulations the virtual quark loops had to be taken into account and the development of new machines and new algorithmic techniques made the so-called dynamical simulations with at least two flavors possible. In recent years, different collaborations studied lattice QCD with dynamical fermions. In our project we study lattice QCD with four degenerated flavors of O(a) improved Wilson quarks in the Schroedinger functional scheme and calculate the energy dependence of the strong coupling constant. For this purpose, we determine the O(a) improvement coefficient c{sub sw} with four flavors and use this result to calculate the step scaling function of QCD with four flavors which describes the scale evolution of the running coupling. Using a recursive finite-size technique, the {lambda} parameter is determined in units of a technical scale L{sub max} which is an unambiguously defined length in the hadronic regime. The coupling {alpha}{sub SF} of QCD in the so-called Schroedinger functional scheme is calculated over a wide range of energies non-perturbatively and compared with 2-loop and 3-loop perturbation theory as well as with the non-perturbative result for only two flavors. (orig.)

  12. Two-loop renormalization of scalar and pseudoscalar fermion bilinears on the lattice

    Science.gov (United States)

    Skouroupathis, A.; Panagopoulos, H.

    2007-11-01

    We compute the two-loop renormalization functions, in the RI' scheme, of local bilinear quark operators ψ¯Γψ, where Γ denotes the scalar and pseudoscalar Dirac matrices, in the lattice formulation of QCD. We consider both the flavor nonsinglet and singlet operators; the latter, in the scalar case, leads directly to the two-loop fermion mass renormalization, Zm. As a prerequisite for the above, we also compute the quark field renormalization, Zψ, up to two loops. We use the clover action for fermions and the Wilson action for gluons. Our results are given as a polynomial in cSW, in terms of both the renormalized and bare coupling constants, in the renormalized Feynman gauge. We also confirm the one-loop renormalization functions, for generic gauge. Finally, we present our results in the MS¯ scheme, for easier comparison with calculations in the continuum. The corresponding results, for fermions in an arbitrary representation, are included in the Appendix.

  13. Two-loop renormalization of scalar and pseudoscalar fermion bilinears on the lattice

    CERN Document Server

    Skouroupathis, A

    2007-01-01

    We compute the two-loop renormalization functions, in the RI $^\\prime$ scheme, of local bilinear quark operators $\\bar{\\psi}\\Gamma\\psi$, where $\\Gamma$ denotes the Scalar and Pseudoscalar Dirac matrices, in the lattice formulation of QCD. We consider both the flavor non-singlet and singlet operators; the latter, in the scalar case, leads directly to the two-loop fermion mass renormalization, $Z_m$. As a prerequisite for the above, we also compute the quark field renormalization, $Z_{\\psi}$, up to two loops. We use the clover action for fermions and the Wilson action for gluons. Our results are given as a polynomial in $c_{SW}$, in terms of both the renormalized and bare coupling constant, in the renormalized Feynman gauge. We also confirm the 1-loop renormalization functions, for generic gauge. Finally, we present our results in the $\\bar{MS}$ scheme, for easier comparison with calculations in the continuum.

  14. A renormalization-group approach to finite-temperature mass corrections

    CERN Document Server

    Marini, A; Marini, A; Burgess, C P

    1994-01-01

    We illustrate how the reorganization of perturbation theory at finite temperature can be economically cast in terms of the Wilson-Polchinski renormalization methods. We take as an example the old saw of the induced thermal mass of a hot scalar field with a quartic coupling, which we compute to second order in the coupling constant. We show that the form of the result can be largely determined by renormalization-group arguments without the explicit evaluation of Feynman graphs.

  15. Density functional theory predictions of isotropic hyperfine coupling constants.

    Science.gov (United States)

    Hermosilla, L; Calle, P; García de la Vega, J M; Sieiro, C

    2005-02-17

    The reliability of density functional theory (DFT) in the determination of the isotropic hyperfine coupling constants (hfccs) of the ground electronic states of organic and inorganic radicals is examined. Predictions using several DFT methods and 6-31G, TZVP, EPR-III and cc-pVQZ basis sets are made and compared to experimental values. The set of 75 radicals here studied was selected using a wide range of criteria. The systems studied are neutral, cationic, anionic; doublet, triplet, quartet; localized, and conjugated radicals, containing 1H, 9Be, 11B, 13C, 14N, 17O, 19F, 23Na, 25Mg, 27Al, 29Si, 31P, 33S, and 35Cl nuclei. The considered radicals provide 241 theoretical hfcc values, which are compared with 174 available experimental ones. The geometries of the studied systems are obtained by theoretical optimization using the same functional and basis set with which the hfccs were calculated. Regression analysis is used as a basic and appropriate methodology for this kind of comparative study. From this analysis, we conclude that DFT predictions of the hfccs are reliable for B3LYP/TZVP and B3LYP/EPR-III combinations. Both functional/basis set scheme are the more useful theoretical tools for predicting hfccs if compared to other much more expensive methods.

  16. Neutron star cooling in various sets of nucleon coupling constants

    Institute of Scientific and Technical Information of China (English)

    DING Wen-Bo; YU Zi; MI Geng; WANG Chun-Yan

    2013-01-01

    The influences of nucleon coupling constants on the neutrino scatting and cooling properties of neutron stars are investigated.The results in the GM1,GPS250 and NL-SH parameter sets show that the magnitude of the neutrino emissivity and density ranges where the dUrca process of nucleons is allowed differ obviously between the three parameter sets in nucleon-only and hyperonic matter.Furthermore,the neutron stars in the GPS250 set cool very quickly,whereas those in the NL-SH set cool slowly.The cooling rate of the former can be almost three times more that of the latter.It can be concluded that the stiffer the equation of state,the slower the corresponding neutron stars cool.The hyperon A makes neutrino emissivity due to the direct Urca process of nucleons lower compared with nucleon-only matter,and postpones the dUrca process with muons.However,these A effects are relatively weaker in the GPS250 set than in the GM1 set.

  17. Orbital effects of spatial variations of fundamental coupling constants

    CERN Document Server

    Iorio, Lorenzo

    2011-01-01

    We deal with the effects induced on the orbit of a test particle revolving around a central body by putative spatial variations of fundamental coupling constants $\\zeta$. In particular, we assume a dipole gradient for $\\zeta(\\bds r)/\\bar{\\zeta}$ along a generic direction $\\bds{\\hat{k}}$ in space. We analytically work out the long-term variations of all the six standard Keplerian orbital elements parameterizing the orbit of a test particle in a gravitationally bound two-body system. It turns out that, apart from the semi-major axis $a$, the eccentricity $e$, the inclination $I$, the longitude of the ascending node $\\Omega$, the longitude of pericenter $\\pi$ and the mean anomaly $\\mathcal{M}$ undergo non-zero long-term changes. By using the usual decomposition along the radial ($R$), transverse ($T$) and normal ($N$) directions, we also analytically work out the long-term changes $\\Delta R,\\Delta T,\\Delta N$ and $\\Delta v_R,\\Delta v_T,\\Delta v_N$ experienced by the position and the velocity vectors $\\bds r$ and...

  18. Hyperfine coupling constants from internally contracted multireference perturbation theory

    CERN Document Server

    Shiozaki, Toru

    2016-01-01

    We present an accurate method for calculating hyperfine coupling constants (HFCCs) based on the complete active space second-order perturbation theory (CASPT2) with full internal contraction. The HFCCs are computed as a first-order property using the relaxed CASPT2 spin-density matrix that takes into account orbital and configurational relaxation due to dynamical electron correlation. The first-order unrelaxed spin-density matrix is calculated from one- and two-body spin-free counterparts that are readily available in the CASPT2 nuclear gradient program [M. K. MacLeod and T. Shiozaki, J. Chem. Phys. 142, 051103 (2015)], whereas the second-order part is computed directly using the newly extended automatic code generator. The relaxation contribution is then calculated from the so-called Z-vectors that are available in the CASPT2 nuclear gradient program. Numerical results are presented for the CN and AlO radicals, for which the CASPT2 values are comparable (or, even superior in some cases) to the ones computed ...

  19. Functional renormalization group study of parallel double quantum dots: Effects of asymmetric dot-lead couplings

    Science.gov (United States)

    Protsenko, V. S.; Katanin, A. A.

    2017-06-01

    We explore the effects of asymmetry of hopping parameters between double parallel quantum dots and the leads on the conductance and a possibility of local magnetic moment formation in this system using functional renormalization group approach with the counterterm. We demonstrate a possibility of a quantum phase transition to a local moment regime [so-called singular Fermi liquid (SFL) state] for various types of hopping asymmetries and discuss respective gate voltage dependencies of the conductance. We show that, depending on the type of the asymmetry, the system can demonstrate either a first-order quantum phase transition to an SFL state, accompanied by a discontinuous change of the conductance, similarly to the symmetric case, or the second-order quantum phase transition, in which the conductance is continuous and exhibits Fano-type asymmetric resonance near the transition point. A semianalytical explanation of these different types of conductance behavior is presented.

  20. Renormalization aspects of N = 1 Super Yang-Mills theory in the Wess-Zumino gauge

    Energy Technology Data Exchange (ETDEWEB)

    Capri, M.A.L.; Granado, D.R.; Guimaraes, M.S.; Justo, I.F.; Sorella, S.P.; Vercauteren, D. [UERJ-Universidade do Estado do Rio de Janeiro, Departamento de Fisica Teorica, Instituto de Fisica, Maracana, Rio de Janeiro (Brazil); Mihaila, L. [Karlsruhe Institute of Technology (KIT), Institut fuer Theoretische Teilchenphysik, Karlsruhe (Germany)

    2014-04-15

    The renormalization of N = 1 Super Yang-Mills theory is analyzed in the Wess-Zumino gauge, employing the Landau condition. An all-orders proof of the renormalizability of the theory is given by means of the Algebraic Renormalization procedure. Only three renormalization constants are needed, which can be identified with the coupling constant, gauge field, and gluino renormalization. The nonrenormalization theorem of the gluon-ghost-antighost vertex in the Landau gauge is shown to remain valid in N = 1 Super Yang-Mills. Moreover, due to the non-linear realization of the supersymmetry in the Wess-Zumino gauge, the renormalization factor of the gauge field turns out to be different from that of the gluino. These features are explicitly checked through a three-loop calculation. (orig.)

  1. Renormalization of fermion mixing

    Energy Technology Data Exchange (ETDEWEB)

    Schiopu, R.

    2007-05-11

    Precision measurements of phenomena related to fermion mixing require the inclusion of higher order corrections in the calculation of corresponding theoretical predictions. For this, a complete renormalization scheme for models that allow for fermion mixing is highly required. The correct treatment of unstable particles makes this task difficult and yet, no satisfactory and general solution can be found in the literature. In the present work, we study the renormalization of the fermion Lagrange density with Dirac and Majorana particles in models that involve mixing. The first part of the thesis provides a general renormalization prescription for the Lagrangian, while the second one is an application to specific models. In a general framework, using the on-shell renormalization scheme, we identify the physical mass and the decay width of a fermion from its full propagator. The so-called wave function renormalization constants are determined such that the subtracted propagator is diagonal on-shell. As a consequence of absorptive parts in the self-energy, the constants that are supposed to renormalize the incoming fermion and the outgoing antifermion are different from the ones that should renormalize the outgoing fermion and the incoming antifermion and not related by hermiticity, as desired. Instead of defining field renormalization constants identical to the wave function renormalization ones, we differentiate the two by a set of finite constants. Using the additional freedom offered by this finite difference, we investigate the possibility of defining field renormalization constants related by hermiticity. We show that for Dirac fermions, unless the model has very special features, the hermiticity condition leads to ill-defined matrix elements due to self-energy corrections of external legs. In the case of Majorana fermions, the constraints for the model are less restrictive. Here one might have a better chance to define field renormalization constants related by

  2. Thermodynamics of weakly coupled Falicov-Kimball chains from renormalization-group theory

    Science.gov (United States)

    Sznajd, Jozef

    2015-06-01

    The linear perturbation renormalization group is used to study spinless two-band fermion chains at half-filling. The model consists of two species of spinless fermions, namely localized f and extended p , and it takes into account the following: the kinetic energy of fermions p , the on-site Coulomb repulsion V between p and f fermions, chemical potentials μp and μf adjusted in such a way that the average of the site occupation + =1 , and a weak interchain hopping tx. The average occupation number, the specific heat, and the correlation functions are studied as functions of temperature. For a single chain the occupation number is a smooth function of T and the specific heat displays two maxima. The weak interchain hopping triggers a discontinuity in the occupation number of fermions as a function of temperature. A long-standing controversy on whether the Falicov-Kimball model can describe a discontinuous transition of nf is also addressed.

  3. Kondo quantum dot coupled to ferromagnetic leads: Numerical renormalization group study

    Science.gov (United States)

    Sindel, M.; Borda, L.; Martinek, J.; Bulla, R.; König, J.; Schön, G.; Maekawa, S.; von Delft, J.

    2007-07-01

    We systematically study the influence of ferromagnetic leads on the Kondo resonance in a quantum dot tuned to the local moment regime. We employ Wilson’s numerical renormalization group method, extended to handle leads with a spin asymmetric density of states, to identify the effects of (i) a finite spin polarization in the leads (at the Fermi surface), (ii) a Stoner splitting in the bands (governed by the band edges), and (iii) an arbitrary shape of the lead density of states. For a generic lead density of states, the quantum dot favors being occupied by a particular spin species due to exchange interaction with ferromagnetic leads, leading to suppression and splitting of the Kondo resonance. The application of a magnetic field can compensate this asymmetry, restoring the Kondo effect. We study both the gate voltage dependence (for a fixed band structure in the leads) and the spin polarization dependence (for fixed gate voltage) of this compensation field for various types of bands. Interestingly, we find that the full recovery of the Kondo resonance of a quantum dot in the presence of leads with an energy-dependent density of states is possible not only by an appropriately tuned external magnetic field but also via an appropriately tuned gate voltage. For flat bands, simple formulas for the splitting of the local level as a function of the spin polarization and gate voltage are given.

  4. Theoretical calculations of hyperfine coupling constants for muoniated butyl radicals.

    Science.gov (United States)

    Chen, Ya Kun; Fleming, Donald G; Wang, Yan Alexander

    2011-04-01

    The hyperfine coupling constants (HFCCs) of all the butyl radicals that can be produced by muonium (Mu) addition to butene isomers (1- and 2-butene and isobutene) have been calculated, to compare with the experimental results for the muon and proton HFFCs for these radicals reported in paper II (Fleming, D. G.; et al. J. Phys. Chem. A 2011, 10.1021/jp109676b) that follows. The equilibrium geometries and HFCCs of these muoniated butyl radicals as well as their unsubstituted isotopomers were treated at both the spin-unrestricted MP2/EPR-III and B3LYP/EPR-III levels of theory. Comparisons with calculations carried out for the EPR-II basis set have also been made. All calculations were carried out in vacuo at 0 K only. A C-Mu bond elongation scheme that lengthens the equilibrium C-H bond by a factor of 1.076, on the basis of recent quantum calculations of the muon HFCCs of the ethyl radical, has been exploited to determine the vibrationally corrected muon HFCCs. The sensitivity of the results to small variations around this scale factor was also investigated. The computational methodology employed was "benchmarked" in comparisons with the ethyl radical, both with higher level calculations and with experiment. For the β-HFCCs of interest, compared to B3LYP, the MP2 calculations agree better with higher level theories and with experiment in the case of the eclipsed C-Mu bond and are generally deemed to be more reliable in predicting the equilibrium conformations and muon HFCCs near 0 K, in the absence of environmental effects. In some cases though, the experimental results in paper II demonstrate that environmental effects enhance the muon HFCC in the solid phase, where much better agreement with the experimental muon HFCCs near 0 K is found from B3LYP than from MP2. This seemingly better level of agreement is probably fortuitous, due to error cancellations in the DFT calculations, which appear to mimic these environmental effects. For the staggered proton HFCCs of the

  5. Functional renormalization group study of orbital fluctuation mediated superconductivity: Impact of the electron-boson coupling vertex corrections

    Science.gov (United States)

    Tazai, Rina; Yamakawa, Youichi; Tsuchiizu, Masahisa; Kontani, Hiroshi

    2016-09-01

    In various multiorbital systems, the emergence of the orbital fluctuations and their role on the pairing mechanism attract increasing attention. To achieve deep understanding on these issues, we perform a functional renormalization group (fRG) study for the two-orbital Hubbard model. The vertex corrections for the electron-boson coupling (U -VC), which are dropped in the Migdal-Eliashberg gap equation, are obtained by solving the RG equation. We reveal that the dressed electron-boson coupling for the charge channel Ûeffc becomes much larger than the bare Coulomb interaction Û 0 due to the U -VC in the presence of moderate spin fluctuations. For this reason, the attractive pairing interaction due to the charge or orbital fluctuations is enlarged by the factor (Ûeffc/Û0) 2≫1 . In contrast, the spin fluctuation pairing interaction is suppressed by the spin-channel U -VC, because of the relation Ûeffs≪Û 0 . The present study demonstrates that the orbital or charge fluctuation pairing mechanism can be realized in various multiorbital systems thanks to the U -VC, such as in Fe-based superconductors.

  6. Spin orbit coupling for molecular ab initio density matrix renormalization group calculations: Application to g-tensors

    Science.gov (United States)

    Roemelt, Michael

    2015-07-01

    Spin Orbit Coupling (SOC) is introduced to molecular ab initio density matrix renormalization group (DMRG) calculations. In the presented scheme, one first approximates the electronic ground state and a number of excited states of the Born-Oppenheimer (BO) Hamiltonian with the aid of the DMRG algorithm. Owing to the spin-adaptation of the algorithm, the total spin S is a good quantum number for these states. After the non-relativistic DMRG calculation is finished, all magnetic sublevels of the calculated states are constructed explicitly, and the SOC operator is expanded in the resulting basis. To this end, spin orbit coupled energies and wavefunctions are obtained as eigenvalues and eigenfunctions of the full Hamiltonian matrix which is composed of the SOC operator matrix and the BO Hamiltonian matrix. This treatment corresponds to a quasi-degenerate perturbation theory approach and can be regarded as the molecular equivalent to atomic Russell-Saunders coupling. For the evaluation of SOC matrix elements, the full Breit-Pauli SOC Hamiltonian is approximated by the widely used spin-orbit mean field operator. This operator allows for an efficient use of the second quantized triplet replacement operators that are readily generated during the non-relativistic DMRG algorithm, together with the Wigner-Eckart theorem. With a set of spin-orbit coupled wavefunctions at hand, the molecular g-tensors are calculated following the scheme proposed by Gerloch and McMeeking. It interprets the effective molecular g-values as the slope of the energy difference between the lowest Kramers pair with respect to the strength of the applied magnetic field. Test calculations on a chemically relevant Mo complex demonstrate the capabilities of the presented method.

  7. Exact renormalization of the photino mass in softly broken N = 1 SQED with N^sub f^ flavors regularized by higher derivatives

    National Research Council Canada - National Science Library

    I V Nartsev; K V Stepanyantz

    2017-01-01

    ... summation of supergraphs. It is important that both these renormalization group functions are defined in terms of the bare coupling constant, so that the considered NSVZ-like relation is valid independently...

  8. Exact renormalization of the photino mass in softly broken N $$ \\mathcal{N} $$ = 1 SQED with N f flavors regularized by higher derivatives

    National Research Council Canada - National Science Library

    Nartsev, I V; Stepanyantz, K V

    2017-01-01

    ... summation of supergraphs. It is important that both these renormalization group functions are defined in terms of the bare coupling constant, so that the considered NSVZ-like relation is valid independently of the subtraction...

  9. Role of zero-point vibrational corrections to carbon hyperfine coupling constants in organic π radicals

    Science.gov (United States)

    Chen, X.; Rinkevicius, Z.; Ruud, K.; Ågren, H.

    2013-02-01

    By analyzing a set of organic π radicals, we demonstrate that zero-point vibrational corrections give significant contributions to carbon hyperfine coupling constants, in one case even inducing a sign reversal for the coupling constant. We discuss the implications of these findings for the computational analysis of electron paramagnetic spectra based on hyperfine coupling constants evaluated at the equilibrium geometry of radicals. In particular, we note that a dynamical description that involves the nuclear motion is in many cases necessary in order to achieve a semi-quantitatively predictive theory for carbon hyperfine coupling constants. In addition, we discuss the implications of the strong dependence of the carbon hyperfine coupling constants on the zero-point vibrational corrections for the selection of exchange-correlation functionals in density functional theory studies of these constants.

  10. Improving the calculation of magnetic coupling constants in MRPT methods.

    Science.gov (United States)

    Spivak, Mariano; Angeli, Celestino; Calzado, Carmen J; de Graaf, Coen

    2014-09-05

    The magnetic coupling in transition metal compounds with more than one unpaired electron per magnetic center has been studied with multiconfigurational perturbation theory. The usual shortcomings of these methodologies (severe underestimation of the magnetic coupling) have been overcome by describing the Slater determinants with a set of molecular orbitals that maximally resemble the natural orbitals of a high-level multiconfigurational reference configuration interaction calculation. These orbitals have significant delocalization tails onto the bridging ligands and largely increase the coupling strengths in the perturbative calculation.

  11. Non-perturbative improvement of quark mass renormalization in two-flavour lattice QCD

    CERN Document Server

    Fritzsch, Patrick; Tantalo, Nazario

    2010-01-01

    We non-perturbatively determine the renormalization constant and the improvement coefficients relating the renormalized current and subtracted quark mass in O(a) improved two-flavour lattice QCD. We employ the Schr\\"odinger functional scheme and fix the physical extent of the box by working at a constant value of the renormalized coupling. Our calculation yields results which cover two regions of bare parameter space. One is the weak-coupling region suitable for volumes of about half a fermi. By making simulations in this region, quarks as heavy as the bottom can be propagated with the full relativistic QCD action and renormalization problems in HQET can be solved non-perturbatively by a matching to QCD in finite volume. The other region refers to the common parameter range in large-volume simulations of two-flavour lattice QCD, where our results have particular relevance for charm physics applications.

  12. The calculation of indirect nuclear spin-spin coupling constants in large molecules.

    Science.gov (United States)

    Watson, Mark A; Sałek, Paweł; Macak, Peter; Jaszuński, Michał; Helgaker, Trygve

    2004-09-20

    We present calculations of indirect nuclear spin-spin coupling constants in large molecular systems, performed using density functional theory. Such calculations, which have become possible because of the use of linear-scaling techniques in the evaluation of the Coulomb and exchange-correlation contributions to the electronic energy, allow us to study indirect spin-spin couplings in molecules of biological interest, without having to construct artificial model systems. In addition to presenting a statistical analysis of the large number of short-range coupling constants in large molecular systems, we analyse the asymptotic dependence of the indirect nuclear spin-spin coupling constants on the internuclear separation. In particular, we demonstrate that, in a sufficiently large one-electron basis set, the indirect spin-spin coupling constants become proportional to the inverse cube of the internuclear separation, even though the diamagnetic and paramagnetic spin-orbit contributions to the spin-spin coupling constants separately decay as the inverse square of this separation. By contrast, the triplet Fermi contact and spin-dipole contributions to the indirect spin-spin coupling constants decay exponentially and as the inverse cube of the internuclear separation, respectively. Thus, whereas short-range indirect spin-spin coupling constants are usually dominated by the Fermi contact contribution, long-range coupling constants are always dominated by the negative diamagnetic spin-orbit contribution and by the positive paramagnetic spin-orbit contribution, with small spin-dipole and negligible Fermi contact contributions.

  13. Universal effective coupling constant ratios of 3D scalar ϕ4 field theory and pseudo-ɛ expansion

    Science.gov (United States)

    Sokolov, A. I.; Nikitina, M. A.; Kudlis, A.

    2016-10-01

    The ratios R2k = g2k/gk - 14 of renormalized coupling constants g2k entering the small-field equation of state approach universal values R*2k at criticality. They are calculated for the three-dimensional λϕ4 field theory within the pseudo-ɛ expansion approach. Pseudo-ɛ expansions for R*6, R*8, R*10 are derived in the five-loop approximation, numerical estimates are obtained with a help of the Padé-Borel-Leroy resummation technique. Its use gives R*6 = 1.6488, the number which perfectly agrees with the most recent lattice result R*6 = 1.649. For the octic coupling the pseudo-ɛ expansion is less favorable numerically. Nevertheless the Padé-Borel-Leroy resummation leads to the estimate R*8 = 0.890 close to the values R*8 = 0.87, R*8 = 0.857 extracted from the lattice and field-theoretical calculations. The pseudo-ɛ expansion for R*10 turns out to have big and rapidly increasing coefficients. This makes correspondent estimates strongly dependent on the Borel-Leroy shift parameter b and prevents proper evaluation of R*10

  14. Universal effective coupling constant ratios of 3D scalar ϕ4 field theory and pseudo-ϵ expansion

    Directory of Open Access Journals (Sweden)

    Sokolov A. I.

    2016-01-01

    Full Text Available The ratios R2k = g2k/gk − 14 of renormalized coupling constants g2k entering the small-field equation of state approach universal values R*2k at criticality. They are calculated for the three-dimensional λϕ4 field theory within the pseudo-ϵ expansion approach. Pseudo-ϵ expansions for R*6, R*8, R*10 are derived in the five-loop approximation, numerical estimates are obtained with a help of the Padé–Borel–Leroy resummation technique. Its use gives R*6 = 1.6488, the number which perfectly agrees with the most recent lattice result R*6 = 1.649. For the octic coupling the pseudo-ϵ expansion is less favorable numerically. Nevertheless the Padé–Borel–Leroy resummation leads to the estimate R*8 = 0.890 close to the values R*8 = 0.87, R*8 = 0.857 extracted from the lattice and field-theoretical calculations. The pseudo-ϵ expansion for R*10 turns out to have big and rapidly increasing coefficients. This makes correspondent estimates strongly dependent on the Borel–Leroy shift parameter b and prevents proper evaluation of R*10

  15. Renormalization of 3d quantum gravity from matrix models

    CERN Document Server

    Ambjørn, Jan; Loll, R

    2004-01-01

    Lorentzian simplicial quantum gravity is a non-perturbatively defined theory of quantum gravity which predicts a positive cosmological constant. Since the approach is based on a sum over space-time histories, it is perturbatively non-renormalizable even in three dimensions. By mapping the three-dimensional theory to a two-matrix model with ABAB interaction we show that both the cosmological and the (perturbatively) non-renormalizable gravitational coupling constant undergo additive renormalizations consistent with canonical quantization.

  16. Calculations of the indirect nuclear spin-spin coupling constants of PbH4

    DEFF Research Database (Denmark)

    Kirpekar, Sheela; Sauer, Stephan P. A.

    1999-01-01

    We report ab initio calculations of the indirect nuclear spin-spin coupling constants of PbH4 using a basis set which was specially optimized for correlated calculations of spin-spin coupling constants. All nonrelativistic contributions and the most important part of the spin-orbit correction were...... approximation and the second-order polarization propagator approximation with coupled-cluster singles and doubles amplitudes. The effects of nuclear motion were investigated by calculating the coupling constants as a function of the totally symmetric stretching coordinate. We find that the Fermi contact term...

  17. From Asymptotic Freedom Toward Heavy Quarkonia Within the Renormalization-Group Procedure for Effective Particles

    Science.gov (United States)

    Gómez-Rocha, María

    2017-03-01

    The renormalization group procedure for effective particles (RGPEP), developed as a nonperturbative tool for constructing bound states in quantum field theories, is applied to QCD. The approach stems from the similarity renormalization group and introduces the concept of effective particles. It has been shown that the RGPEP passes the test of exhibiting asymptotic freedom. We present the running of the Hamiltonian coupling constant with the renormalization-group scale and we summarize the basic elements needed in the formulation of the bound-state problem.

  18. Effective method for calculation of the analytic QCD coupling constant

    CERN Document Server

    Alekseev, A Yu

    2002-01-01

    The analytic running coupling of strong interaction alpha sub a sub n for initial standard perturbative approximations up to three-loop order is studied. The nonperturbative contributions to alpha sub a sub n are obtained in an explicit form. They are shown to be represented in the form of the expansion in the inverse powers of Euclidean momentum squared. It is shown that two-loop and three-loop-order corrections result in partial compensation of one-loop-order leading in the ultraviolet region nonperturbative contribution of the form 1/q sup 2. On basis of the stated expansion the effective method for calculation of the analytic running coupling is developed for all q > LAMBDA. The comparative analysis of the perturbative and nonperturbative contributions is carried out in the momentum dependence of alpha sub a sub n and its perturbative component for one - three-loop cases leads to a conclusion on higher loop stability of the analytic running coupling and its low dependence on the n sub f -threshold matchin...

  19. Renormalization and effective actions for general relativity

    Energy Technology Data Exchange (ETDEWEB)

    Neugebohrn, F.

    2007-05-15

    Quantum gravity is analyzed from the viewpoint of the renormalization group. The analysis is based on methods introduced by J. Polchinski concerning the perturbative renormalization with flow equations. In the first part of this work, the program of renormalization with flow equations is reviewed and then extended to effective field theories that have a finite UV cutoff. This is done for a scalar field theory by imposing additional renormalization conditions for some of the nonrenormalizable couplings. It turns out that one so obtains a statement on the predictivity of the effective theory at scales far below the UV cutoff. In particular, nonrenormalizable theories can be treated without problems in the proposed framework. In the second part, the standard covariant BRS quantization program for Euclidean Einstein gravity is applied. A momentum cutoff regularization is imposed and the resulting violation of the Slavnov-Taylor identities is discussed. Deriving Polchinski's renormalization group equation for Euclidean quantum gravity, the predictivity of effective quantum gravity at scales far below the Planck scale is investigated with flow equations. A fine-tuning procedure for restoring the violated Slavnov-Taylor identities is proposed and it is argued that in the effective quantum gravity context, the restoration will only be accomplished with finite accuracy. Finally, the no-cutoff limit of Euclidean quantum gravity is analyzed from the viewpoint of the Polchinski method. It is speculated whether a limit with nonvanishing gravitational constant might exist where the latter would ultimatively be determined by the cosmological constant and the masses of the elementary particles. (orig.)

  20. Renormalization Group Flows from D=3, N=2 Matter Coupled Gauged Supergravities

    CERN Document Server

    Deger, N S

    2002-01-01

    We study holographic RG flows of N=2 matter couple AdS_3 supergravities which admit both compact and non-compact sigma manifolds. For the compact case the supersymmetric domain wall solution interpolates between a conformal IR region and flat spacetime and this corresponds to a deformation of the CFT by an irrelevant operator. When it is non-compact, the solution can be interpreted as a flow between an UV fixed point and a non-conformal(singular) IR region. This is an exact example of a deformation flow when the singularity is physical. We also find a non-supersymmetric deformation flow when the scalar potential has a second AdS vacua. The ratio of the central charges is rational for certain values of the size of the sigma model. Next, we analyze the spectrum of a massless scalar on our background by transforming the problem into Schroedinger form. The spectrum is continuous for the compact model, yet it can be both continuous (with and without mass gap) and discrete otherwise. Finally, 2-point functions are ...

  1. A QCDSR calculation of the J/ψD* sDs strong coupling constant

    Science.gov (United States)

    Osório Rodrigues, B.; Bracco, M. E.; Chiapparini, M.; Cerqueira, A., Jr.

    2016-04-01

    In this work, we evaluate the coupling constant and the form factors of the vertex J/ψDs using the techniques of the QCD sum rules. We consider all the three mesons off shell, resulting in three different form factors. However, despite the different form factors, when extrapolated to the pole of each off-shell meson, we find coupling constants that are in completely agreement each other. The result for the vertex J/ψDs coupling constant is gJ/ψD* sDs =4.30+0.42 -0.37GeV-1.

  2. Strong coupling constant of negative parity nucleon with $\\pi$ meson in light cone QCD sum rules

    CERN Document Server

    Aliev, T M; Savcı, M

    2016-01-01

    We estimate strong coupling constant between the negative parity nucleons with $\\pi$ meson within the light cone QCD sum rules. A method for eliminating the unwanted contributions coming from the nucleon--nucleon and nucleon--negative parity nucleon transition is presented. It is observed that the value strong coupling constant of the negative parity nucleon $N^\\ast N^\\ast \\pi$ transition is considerably different from the one predicted by the 3--point QCD sum rules, but is quite close to the coupling constant of the positive parity $N N \\pi$ transition.

  3. Constraints on the Moment of Inertia of a Proto Neutron Star from the Hyperon Coupling Constants

    Indian Academy of Sciences (India)

    Xian-Feng Zhao; Huan-Yu Jia

    2012-09-01

    The influence of the hyperon coupling constants on the moment of inertia of a proto neutron star has been investigated within the framework of relativistic mean field theory for the baryon octet {, , , -, 0, +, Ξ-, Ξ0} system. It is found that for a proto neutron star, the mass, the moment of inertia and their own maximum values as a function of radius or / are all more sensitive to the hyperon coupling constants. For all the different hyperon coupling constants mentioned, the case of no hyperons corresponds to the largest moment of inertia.

  4. Precise Determination of Charge Dependent Pion-Nucleon-Nucleon Coupling Constants

    CERN Document Server

    Perez, R Navarro; Arriola, E Ruiz

    2016-01-01

    We undertake a covariance error analysis of the pion-nucleon-nucleon coupling constants from the Granada-2013 np and pp database comprising a total of 6713 scattering data. Assuming a unique pion-nucleon coupling constant we obtain $f^2=0.0761(3)$. The effects of charge symmetry breaking on the $^3P_0$, $^3P_1$ and $^3P_2$ partial waves are analyzed and we find $f_{p}^2 = 0.0759(4)$, $f_{0}^2 = 0.079(1)$ and $f_{c}^2 = 0.0763(6)$ with minor correlations among the coupling constants. We successfully test normality for the residuals of the fit.

  5. Ro-vibrational averaging of the isotropic hyperfine coupling constant for the methyl radical

    Energy Technology Data Exchange (ETDEWEB)

    Adam, Ahmad Y.; Jensen, Per, E-mail: jensen@uni-wuppertal.de [Fakultät Mathematik und Naturwissenschaften, Physikalische und Theoretische Chemie, Bergische Universität Wuppertal, D-42097 Wuppertal (Germany); Yachmenev, Andrey; Yurchenko, Sergei N. [Department of Physics and Astronomy, University College London, Gower Street, London WC1E 6BT (United Kingdom)

    2015-12-28

    We present the first variational calculation of the isotropic hyperfine coupling constant of the carbon-13 atom in the CH{sub 3} radical for temperatures T = 0, 96, and 300 K. It is based on a newly calculated high level ab initio potential energy surface and hyperfine coupling constant surface of CH{sub 3} in the ground electronic state. The ro-vibrational energy levels, expectation values for the coupling constant, and its temperature dependence were calculated variationally by using the methods implemented in the computer program TROVE. Vibrational energies and vibrational and temperature effects for coupling constant are found to be in very good agreement with the available experimental data. We found, in agreement with previous studies, that the vibrational effects constitute about 44% of the constant’s equilibrium value, originating mainly from the large amplitude out-of-plane bending motion and that the temperature effects play a minor role.

  6. Analytic Continuation in the Coupling Constant Method for the Dirac Equation

    Institute of Scientific and Technical Information of China (English)

    张时声; 郭建友; 张双全; 孟杰

    2004-01-01

    On the basis of the Dirac equation, the analytic continuation in the coupling constant method is employed to investigate the energies and widths of single-particle resonant in square-well, harmonic-oscillator, and Woodsconvergent energies and widths of single-particle resonant states can be obtained, which makes the application of the analytic continuation in the coupling constant for the relativistic mean field theory possible.

  7. Coupling constant of triple-clad long-period fiber grating

    Institute of Scientific and Technical Information of China (English)

    GU Zheng-tian; XU Yan-ping; CHEN Jia-bi

    2006-01-01

    Based on the method of vector-field analysis,the relationship between the core-mode/cladding-mode coupling constant kcl-co1v-11 and mode order v is studied.It could be seen that the coupling constants of the l=1 low-order HE cladding modes are larger than that of the l=1 low-order EH cladding modes when v≤41.For cladding modes with v>41,the coupling constants of the l=1 low-order HE and EH modes are comparable to each other.The plotted local intensity curves of the six lowest-order(l=1) cladding modes show that the low-order HE modes have a larger proportion of intensity located in the core than the low-order EH modes.Further,the relationship between the coupling constant kcl-co1v-11 and the film refractive index as well as the film thickness is studied.The results indicate that the coupling constant changes monotonously with the film refractive index changing.As the film thickness increases,the coupling constant decreases slowly with irregularly changes in a certain region of the film thickness,which matches the experimental results of Nicholas D.R.

  8. Chemical reactivity in nucleophilic cycloaddition to C70: vibronic coupling density and vibronic coupling constants as reactivity indices.

    Science.gov (United States)

    Haruta, Naoki; Sato, Tohru; Tanaka, Kazuyoshi

    2012-11-02

    The chemical reactivity in nucleophilic cycloaddition to C70 is investigated on the basis of vibronic (electron-vibration) coupling density and vibronic coupling constants. Because the e1″ LUMOs of C70 are doubly degenerate and delocalized throughout the molecule, it is difficult to predict the regioselectivity by frontier orbital theory. It is found that vibronic coupling density analysis for the effective mode as a reaction mode illustrates the idea of a functional group embedded in the reactive sites. Furthermore, the vibronic coupling constants for localized stretching vibrational modes enable us to estimate the quantitative reactivity. These calculated results agree well with the experimental findings. The principle of chemical reactivity proposed by Parr and Yang is modified as follows: the preferred direction is the one for which the initial vibronic coupling density for a reaction mode of the isolated reactant is a minimum.

  9. Measurement of the strong coupling constant {alpha}{sub s} with hadronic jets in deep inelastic scattering; Mesure de la constante de couplage forte {alpha}{sub s} avec les jets hadroniques en diffusion inelastique profonde

    Energy Technology Data Exchange (ETDEWEB)

    Gouzevitch, Maxime

    2008-12-15

    In this analysis we have used the production of hard jets in neutral-current DIS for the extraction of the strong coupling constant {alpha}{sub s}. The jets have been selected in the NC DIS events at large momentum transvers 1505. Three jet observables normalized to the total NC DIS cross section have been used: Inclusive jet multiplicity as well as the production rates of 2-jet and 3-jet events. The prediction of the renormalization-group equation for the evolution of the strong coupling constant has been successfully tested for two orders of magnitude between Q=2 QeV to Q=122 GeV. The better precision on {alpha}{sub s}(m{sub Z}) has been obtained with the combination ob the three observables at Q{sup 2}>150 GeV{sup 2}: {alpha}{sub s}(m{sub Z})=0.1180{+-}0.0007(exp.){sub -0.0034}{sup +0.0050}(th.){+-}0.0017(pdf.).

  10. What ξ? Cosmological constraints on the non-minimal coupling constant

    Science.gov (United States)

    Hrycyna, Orest

    2017-05-01

    In dynamical system describing evolution of universe with the flat Friedmann-Robertson-Walker symmetry filled with barotropic dust matter and non-minimally coupled scalar field with a constant potential function an invariant manifold of the de Sitter state is used to obtain exact solutions of the reduced dynamics. Using observational data coming from distant supernovae type Ia, the Hubble function H (z) measurements and information coming from the Alcock-Paczyński test we find cosmological constraints on the non-minimal coupling constant ξ between the scalar curvature and the scalar field. For all investigated models we can exclude negative values of this parameter at the 68% confidence level. We obtain constraints on the non-minimal coupling constant consistent with condition for conformal coupling of the scalar field in higher dimensional theories of gravity.

  11. Indirect NMR spin-spin coupling constants in diatomic alkali halides.

    Science.gov (United States)

    Jaszuński, Michał; Antušek, Andrej; Demissie, Taye B; Komorovsky, Stanislav; Repisky, Michal; Ruud, Kenneth

    2016-12-28

    We report the Nuclear Magnetic Resonance (NMR) spin-spin coupling constants for diatomic alkali halides MX, where M = Li, Na, K, Rb, or Cs and X = F, Cl, Br, or I. The coupling constants are determined by supplementing the non-relativistic coupled-cluster singles-and-doubles (CCSD) values with relativistic corrections evaluated at the four-component density-functional theory (DFT) level. These corrections are calculated as the differences between relativistic and non-relativistic values determined using the PBE0 functional with 50% exact-exchange admixture. The total coupling constants obtained in this approach are in much better agreement with experiment than the standard relativistic DFT values with 25% exact-exchange, and are also noticeably better than the relativistic PBE0 results obtained with 50% exact-exchange. Further improvement is achieved by adding rovibrational corrections, estimated using literature data.

  12. Dimensional Reduction, Hard Thermal Loops and the Renormalization Group

    CERN Document Server

    Stephens, C R; Hess, P O; Astorga, F; Weber, Axel; Hess, Peter O.; Astorga, Francisco

    2004-01-01

    We study the realization of dimensional reduction and the validity of the hard thermal loop expansion for lambda phi^4 theory at finite temperature, using an environmentally friendly finite-temperature renormalization group with a fiducial temperature as flow parameter. The one-loop renormalization group allows for a consistent description of the system at low and high temperatures, and in particular of the phase transition. The main results are that dimensional reduction applies, apart from a range of temperatures around the phase transition, at high temperatures (compared to the zero temperature mass) only for sufficiently small coupling constants, while the HTL expansion is valid below (and rather far from) the phase transition, and, again, at high temperatures only in the case of sufficiently small coupling constants. We emphasize that close to the critical temperature, physics is completely dominated by thermal fluctuations that are not resummed in the hard thermal loop approach and where universal quant...

  13. Temperature dependence of (+)-catechin pyran ring proton coupling constants as measured by NMR and modeled using GMMX search methodology

    Science.gov (United States)

    Fred L. Tobiason; Stephen S. Kelley; M. Mark Midland; Richard W. Hemingway

    1997-01-01

    The pyran ring proton coupling constants for (+)-catechin have been experimentally determined in deuterated methanol over a temperature range of 213 K to 313 K. The experimental coupling constants were simulated to 0.04 Hz on the average at a 90 percent confidence limit using a LAOCOON method. The temperature dependence of the coupling constants was reproduced from the...

  14. Wave function and CKM renormalization

    CERN Document Server

    Espriu, Doménec

    2002-01-01

    In this presentation we clarify some aspects of the LSZ formalism and wave function renormalization for unstable particles in the presence of electroweak interactions when mixing and CP violation are considered. We also analyze the renormalization of the CKM mixing matrix which is closely related to wave function renormalization. The effects due to the electroweak radiative corrections that are described in this work are small, but they will need to be considered when the precision in the measurement of the charged current sector couplings reaches the 1% level. The work presented here is done in collaboration with Julian Manzano and Pere Talavera.

  15. BRST Renormalization

    Science.gov (United States)

    Lavrov, P. M.; Shapiro, I. L.

    2012-09-01

    We consider the renormalization of general gauge theories on curved space-time background, with the main assumption being the existence of a gauge-invariant and diffeomorphism invariant regularization. Using the Batalin-Vilkovisky (BV) formalism one can show that the theory possesses gauge invariant and diffeomorphism invariant renormalizability at quantum level, up to an arbitrary order of the loop expansion.

  16. A Constraint on Defect and Boundary Renormalization Group Flows

    CERN Document Server

    Jensen, Kristan

    2015-01-01

    A conformal field theory (CFT) in dimension $d\\geq 3$ coupled to a planar, two-dimensional, conformal defect is characterized in part by a "central charge" $b$ that multiplies the Euler density in the defect's Weyl anomaly. For defect renormalization group flows, under which the bulk remains critical, we use reflection positivity to show that $b$ must decrease or remain constant from ultraviolet to infrared. Our result applies also to a CFT in $d=3$ flat space with a planar boundary.

  17. Massive renormalization scheme and perturbation theory at finite temperature

    Energy Technology Data Exchange (ETDEWEB)

    Blaizot, Jean-Paul, E-mail: jean-paul.blaizot@cea.fr [Institut de Physique Théorique, CNRS/URA2306, CEA-Saclay, 91191 Gif-sur-Yvette (France); Wschebor, Nicolás [Instituto de Fìsica, Faculdad de Ingeniería, Universidade de la República, 11000 Montevideo (Uruguay)

    2015-02-04

    We argue that the choice of an appropriate, massive, renormalization scheme can greatly improve the apparent convergence of perturbation theory at finite temperature. This is illustrated by the calculation of the pressure of a scalar field theory with quartic interactions, at 2-loop order. The result, almost identical to that obtained with more sophisticated resummation techniques, shows a remarkable stability as the coupling constant grows, in sharp contrast with standard perturbation theory.

  18. Constraint on Defect and Boundary Renormalization Group Flows.

    Science.gov (United States)

    Jensen, Kristan; O'Bannon, Andy

    2016-03-04

    A conformal field theory (CFT) in dimension d≥3 coupled to a planar, two-dimensional, conformal defect is characterized in part by a "central charge" b that multiplies the Euler density in the defect's Weyl anomaly. For defect renormalization group flows, under which the bulk remains critical, we use reflection positivity to show that b must decrease or remain constant from the ultraviolet to the infrared. Our result applies also to a CFT in d=3 flat space with a planar boundary.

  19. Renormalized Cosmological Perturbation Theory

    CERN Document Server

    Crocce, M

    2006-01-01

    We develop a new formalism to study nonlinear evolution in the growth of large-scale structure, by following the dynamics of gravitational clustering as it builds up in time. This approach is conveniently represented by Feynman diagrams constructed in terms of three objects: the initial conditions (e.g. perturbation spectrum), the vertex (describing non-linearities) and the propagator (describing linear evolution). We show that loop corrections to the linear power spectrum organize themselves into two classes of diagrams: one corresponding to mode-coupling effects, the other to a renormalization of the propagator. Resummation of the latter gives rise to a quantity that measures the memory of perturbations to initial conditions as a function of scale. As a result of this, we show that a well-defined (renormalized) perturbation theory follows, in the sense that each term in the remaining mode-coupling series dominates at some characteristic scale and is subdominant otherwise. This is unlike standard perturbatio...

  20. Constraining differential renormalization in abelian gauge theories

    CERN Document Server

    del Águila, F; Tapia, R M; Pérez-Victoria, M

    1998-01-01

    We present a procedure of differential renormalization at the one loop level which avoids introducing unnecessary renormalization constants and automatically preserves abelian gauge invariance. The amplitudes are expressed in terms of a basis of singular functions. The local terms appearing in the renormalization of these functions are determined by requiring consistency with the propagator equation. Previous results in abelian theories, with and without supersymmetry, are discussed in this context.

  1. Proof of NRQCD factorization at all orders in the coupling constant in heavy quarkonium production

    Energy Technology Data Exchange (ETDEWEB)

    Nayak, Gouranga C.

    2016-08-15

    Recently the proof of the factorization in heavy quarkonium production in the NRQCD color octet mechanism is given at next-to-next-to-leading order (NNLO) in the coupling constant by using diagrammatic method of QCD. In this paper we prove factorization in heavy quarkonium production in the NRQCD color octet mechanism at all orders in the coupling constant by using the path integral method of QCD. Our proof is valid to all powers in the relative velocity of the heavy quark. We find that the gauge invariance and the factorization at all orders in the coupling constant require gauge-completed non-perturbative NRQCD matrix elements that were introduced previously to prove factorization at NNLO. (orig.)

  2. Calculation of indirect nuclear spin-spin coupling constants within the regular approximation for relativistic effects.

    Science.gov (United States)

    Filatov, Michael; Cremer, Dieter

    2004-06-22

    A new method for calculating the indirect nuclear spin-spin coupling constant within the regular approximation to the exact relativistic Hamiltonian is presented. The method is completely analytic in the sense that it does not employ numeric integration for the evaluation of relativistic corrections to the molecular Hamiltonian. It can be applied at the level of conventional wave function theory or density functional theory. In the latter case, both pure and hybrid density functionals can be used for the calculation of the quasirelativistic spin-spin coupling constants. The new method is used in connection with the infinite-order regular approximation with modified metric (IORAmm) to calculate the spin-spin coupling constants for molecules containing heavy elements. The importance of including exact exchange into the density functional calculations is demonstrated.

  3. Relativistic force field: parametric computations of proton-proton coupling constants in (1)H NMR spectra.

    Science.gov (United States)

    Kutateladze, Andrei G; Mukhina, Olga A

    2014-09-05

    Spin-spin coupling constants in (1)H NMR carry a wealth of structural information and offer a powerful tool for deciphering molecular structures. However, accurate ab initio or DFT calculations of spin-spin coupling constants have been very challenging and expensive. Scaling of (easy) Fermi contacts, fc, especially in the context of recent findings by Bally and Rablen (Bally, T.; Rablen, P. R. J. Org. Chem. 2011, 76, 4818), offers a framework for achieving practical evaluation of spin-spin coupling constants. We report a faster and more precise parametrization approach utilizing a new basis set for hydrogen atoms optimized in conjunction with (i) inexpensive B3LYP/6-31G(d) molecular geometries, (ii) inexpensive 4-31G basis set for carbon atoms in fc calculations, and (iii) individual parametrization for different atom types/hybridizations, not unlike a force field in molecular mechanics, but designed for the fc's. With the training set of 608 experimental constants we achieved rmsd <0.19 Hz. The methodology performs very well as we illustrate with a set of complex organic natural products, including strychnine (rmsd 0.19 Hz), morphine (rmsd 0.24 Hz), etc. This precision is achieved with much shorter computational times: accurate spin-spin coupling constants for the two conformers of strychnine were computed in parallel on two 16-core nodes of a Linux cluster within 10 min.

  4. Characterizing the interphase dielectric constant of polymer composite materials: Effect of chemical coupling agents

    Science.gov (United States)

    Todd, Michael G.; Shi, Frank G.

    2003-10-01

    Recent research into the dielectric characteristics of polymer-ceramic composites has shown that the interphase region of the composite can have a dielectric constant significantly different from that of the polymer phase due to covalent bonding of the polymer molecules to the surface of the filler particles. Chemical coupling agents and surfactants such as functional silanes, organotitanates, organometallic chelating agents, phosphate esters, and various ionic and nonionic organic esters are commonly employed to enhance the compatibility between the polymer phase and dispersed filler phase of composite systems. Using experimental data and molecular dipole polarization calculations, we determine the effect of such coupling agents on the interphase dielectric constant. Our results show that the addition of functional silane coupling agents or nonionic surfactants at concentrations of 0.5 wt % or less of the total organics of a polymer-ceramic composite system has significant effects on the dielectric constant of the interphase region, yet has little or no effect on the dielectric constant values of the polymer phase. Furthermore, the chemical bonding of the coupling agents to the ceramic filler particles determine the dielectric constant of the interphase region as predicted by chemical polarization calculations. These results are fully consistent with experimental evidence and further validate the use of molecular polarization calculations of composite interphase regions to determine and predict the overall effective dielectric properties of packaging materials for a wide range of electrical, electronic, and rf applications.

  5. O.P.E. and Power Corrections to the QCD coupling constant

    CERN Document Server

    Boucaud, P; Leroy, J P; Le Yaouanc, A; Micheli, J; Moutarde, H; Pène, O; Rodríguez-Quintero, J; Boucaud, Ph.

    2003-01-01

    Lattice data seems to show that power corrections should be convoked to describe appropriately the transition of the QCD coupling constant running from U.V. to I.R. domains. Those power corrections for the Landau-gauge MOM coupling constant in a pure Yang-Mills theory (N_f=0) are analysed in terms of Operator Product Expansion (O.P.E.) of two- and three-point Green functions, the gluon condensate emerging from this study. The semi-classical picture given by instantons can be also used to look for into the nature of the power corrections and gluon condensate.

  6. High-Precision Calculations in Strongly Coupled Quantum Field Theory with Next-to-Leading-Order Renormalized Hamiltonian Truncation arXiv

    CERN Document Server

    Elias-Miro, Joan; Vitale, Lorenzo G.

    Hamiltonian Truncation (a.k.a. Truncated Spectrum Approach) is an efficient numerical technique to solve strongly coupled QFTs in d=2 spacetime dimensions. Further theoretical developments are needed to increase its accuracy and the range of applicability. With this goal in mind, here we present a new variant of Hamiltonian Truncation which exhibits smaller dependence on the UV cutoff than other existing implementations, and yields more accurate spectra. The key idea for achieving this consists in integrating out exactly a certain class of high energy states, which corresponds to performing renormalization at the cubic order in the interaction strength. We test the new method on the strongly coupled two-dimensional quartic scalar theory. Our work will also be useful for the future goal of extending Hamiltonian Truncation to higher dimensions d >= 3.

  7. Renormalization Group Invariance and Optimal QCD Renormalization Scale-Setting

    CERN Document Server

    Wu, Xing-Gang; Wang, Sheng-Quan; Fu, Hai-Bing; Ma, Hong-Hao; Brodsky, Stanley J; Mojaza, Matin

    2014-01-01

    A valid prediction from quantum field theory for a physical observable should be independent of the choice of renormalization scheme -- this is the primary requirement of renormalization group invariance (RGI). Satisfying scheme invariance is a challenging problem for perturbative QCD (pQCD), since truncated perturbation series do not automatically satisfy the requirements of the renormalization group. Two distinct approaches for satisfying the RGI principle have been suggested in the literature. One is the "Principle of Maximum Conformality" (PMC) in which the terms associated with the $\\beta$-function are absorbed into the scale of the running coupling at each perturbative order; its predictions are scheme and scale independent at every finite order. The other approach is the "Principle of Minimum Sensitivity" (PMS), which is based on local RGI; the PMS approach determines the optimal renormalization scale by requiring the slope of the approximant of an observable to vanish. In this paper, we present a deta...

  8. SOPPA and CCSD vibrational corrections to NMR indirect spin-spin coupling constants of small hydrocarbons

    Energy Technology Data Exchange (ETDEWEB)

    Faber, Rasmus; Sauer, Stephan P. A. [Department of Chemistry, University of Copenhagen, Universitetsparken 5, DK-2100 Copenhagen Ø (Denmark)

    2015-12-31

    We present zero-point vibrational corrections to the indirect nuclear spin-spin coupling constants in ethyne, ethene, cyclopropene and allene. The calculations have been carried out both at the level of the second order polarization propagator approximation (SOPPA) employing a new implementation in the DALTON program, at the density functional theory level with the B3LYP functional employing also the Dalton program and at the level of coupled cluster singles and doubles (CCSD) theory employing the implementation in the CFOUR program. Specialized coupling constant basis sets, aug-cc-pVTZ-J, have been employed in the calculations. We find that on average the SOPPA results for both the equilibrium geometry values and the zero-point vibrational corrections are in better agreement with the CCSD results than the corresponding B3LYP results. Furthermore we observed that the vibrational corrections are in the order of 5 Hz for the one-bond carbon-hydrogen couplings and about 1 Hz or smaller for the other couplings apart from the one-bond carbon-carbon coupling (11 Hz) and the two-bond carbon-hydrogen coupling (4 Hz) in ethyne. However, not for all couplings lead the inclusion of zero-point vibrational corrections to better agreement with experiment.

  9. The Relativistic Effects on the Carbon-Carbon Coupling Constants Mediated by a Heavy Atom.

    Science.gov (United States)

    Wodyński, Artur; Malkina, Olga L; Pecul, Magdalena

    2016-07-21

    The (2)JCC, (3)JCC, and (4)JCC spin-spin coupling constants in the systems with a heavy atom (Cd, In, Sn, Sb, Te, Hg, Tl, Pb, Bi, and Po) in the coupling path have been calculated by means of density functional theory. The main goal was to estimate the relativistic effects on spin-spin coupling constants and to explore the factors which may influence them, including the nature of the heavy atom and carbon hybridization. The methods applied range, in order of reduced complexity, from the Dirac-Kohn-Sham (DKS) method (density functional theory with four-component Dirac-Coulomb Hamiltonian), through DFT with two- and one-component zeroth-order regular approximation (ZORA) Hamiltonians, to scalar effective core potentials (ECPs) with the nonrelativistic Hamiltonian. The use of DKS and ZORA methods leads to very similar results, and small-core ECPs of the MDF and MWB variety reproduce correctly the scalar relativistic effects. Scalar relativistic effects usually are larger than the spin-orbit coupling effects. The latter tend to influence the most the coupling constants of the sp(3)-hybridized carbon atoms and in compounds of the p-block heavy atoms. Large spin-orbit coupling contributions for the Po compounds are probably connected with the inverse of the lowest triplet excitation energy.

  10. Strong coupling constant of negative parity octet baryons with light pseudoscalar mesons in light cone QCD sum rules

    CERN Document Server

    Aliev, T M

    2016-01-01

    The strong coupling constants of the $\\pi$ and $K$ mesons with negative parity octet baryons are estimated within the light cone QCD sum rules. It is observed that all strong coupling constants, similar to the case for the positive parity baryons, can be described in terms of three invariant functions, where two of them correspond to the well known $F$ and $D$ couplings in the $SU(3)_f$ symmetry, and the third function describes the $SU(3)_f$ symmetry violating effects. We compare our predictions on the strong coupling constants of pseudoscalar mesons of negative parity baryons with those corresponding to the strong coupling constants for the positive parity baryons.

  11. A Measurement Of The Strong Coupling Constant From Jet Analysis At Babar

    CERN Document Server

    Ford, K E

    2001-01-01

    I measure the two-, three- and four-jet fractions in the four flavour continuum near s≈10.5 GeV. From this, I extracted a value for the strong coupling constant (αs) of αs(10.53GeV) = 0.1319 ± 0.0848 ± 0.0100.

  12. Dark Energy Model with Non-Minimal Coupling and Cosmological Constant Boundary

    Institute of Scientific and Technical Information of China (English)

    张晓菲

    2011-01-01

    In this paper, we study a kind of dark energy models in the framework of the non-minimal coupling. With this kind of models, dark energy could cross the cosmological constant boundary, and at early time, dark energy could have "tracking" behavior.

  13. Stellar delta matter with delta-meson coupling constants constrained by QCD sum rule

    Energy Technology Data Exchange (ETDEWEB)

    Silva, Antonio Ferreira da [Secretaria de Educacao, Cultura e Desportos do Estado de Roraima (SECD/RR), Boa Vista, RR (Brazil); Oliveira, Jose Carlos Teixeira de [Universidade Federal de Roraima (UFRR), Boa Vista, RR (Brazil); Rodrigues, Hilario [Centro Federal de Educacao Tecnologica (CEFET-RJ), Rio de Janeiro, RJ (Brazil); Duarte, Sergio Barbosa [Centro Brasileiro de Pesquisas Fisicas (CBPF), Rio de Janeiro, RJ (Brazil); Chiapparini, Marcelo [Universidade do Estado do Rio de Janeiro (UERJ), RJ (Brazil)

    2010-07-01

    The considerable presence of delta-resonances (30% of baryonic population) in the dense phase of relativistic heavy ion collisions leads to a great interest in the study of the delta matter formation in the deep interior of compact stars. In the present work we determine the equation of state and the population of baryons and leptons and discuss the effects of the baryon-meson coupling constants to the formation of delta matter in the stellar medium. We use the non-linear Walecka model consisting of the octet of baryons of spin 1=2 (n, p, {Lambda}{sup 0}, {Sigma}{sup -}, {Sigma}{sup 0}, {Sigma}{sup +}, {Xi}{sup -}, {Xi}{sup 0}) and baryonic resonances of spin 3=2, represented by the delta resonances ({Delta}{sup -}, ({Delta}{sup 0}, ({Delta}{sup +}, ({Delta}{sup ++}) and {Omega}{sup -}, in the baryonic sector. In the leptonic sector we consider the electrons and muons. The coupling constants between the hyperons {Lambda}, {Sigma}, and {Xi} and the mesons {omega} and {rho} are fixed by using SU(6) symmetry, while the hyperons-{sigma} coupling constants are constrained by the consistence of the hypernuclear potential in the nuclear matter with hypernuclear data. In addition, we use the finite density QCD sum rule to determine the possible values of delta-meson coupling constants. (author)

  14. The variation of the fine-structure constant from disformal couplings

    Science.gov (United States)

    van de Bruck, Carsten; Mifsud, Jurgen; Nunes, Nelson J.

    2015-12-01

    We study a theory in which the electromagnetic field is disformally coupled to a scalar field, in addition to a usual non-minimal electromagnetic coupling. We show that disformal couplings modify the expression for the fine-structure constant, α. As a result, the theory we consider can explain the non-zero reported variation in the evolution of α by purely considering disformal couplings. We also find that if matter and photons are coupled in the same way to the scalar field, disformal couplings itself do not lead to a variation of the fine-structure constant. A number of scenarios are discussed consistent with the current astrophysical, geochemical, laboratory and the cosmic microwave background radiation constraints on the cosmological evolution of α. The models presented are also consistent with the current type Ia supernovae constraints on the effective dark energy equation of state. We find that the Oklo bound in particular puts strong constraints on the model parameters. From our numerical results, we find that the introduction of a non-minimal electromagnetic coupling enhances the cosmological variation in α. Better constrained data is expected to be reported by ALMA and with the forthcoming generation of high-resolution ultra-stable spectrographs such as PEPSI, ESPRESSO, and ELT-HIRES. Furthermore, an expected increase in the sensitivity of molecular and nuclear clocks will put a more stringent constraint on the theory.

  15. What $\\xi$ ? Cosmological constraints on the non-minimal coupling constant

    CERN Document Server

    Hrycyna, Orest

    2015-01-01

    In dynamical system describing evolution of universe with the flat Friedmann-Robertson-Walker symmetry filled with barotropic dust matter and non-minimally coupled scalar field with a constant potential function an invariant manifold of the de Sitter state is used to obtain exact solutions of the reduced dynamics. Using observational data coming from distant supernovae type Ia, the Hubble function $H(z)$ measurements and information coming from the Alcock-Paczy$\\'n$ski test we find cosmological constraints on the non-minimal coupling constant $\\xi$ between the scalar curvature and the scalar field. For all investigated models we can exclude negative values of this parameter at the $68\\%$ confidence level. We obtain coherence with values needed for conformal coupling of the scalar field in higher dimensional theories of gravity.

  16. Normal-2SC mixed phase of quark matter in compact stars for large coupling constant

    CERN Document Server

    Aguilera, D N; Grigorian, H

    2004-01-01

    We study the consequences of changing the ratio $\\eta$ between the coupling constant in the diquark channel and the coupling constant in the messon channel to a quark matter equation of state under compact stars constraints. A nonlocal chiral quark model is used and the quark interaction is represented via formfactor functions. We found that a mixed phase of 2SC quark matter and normal quark matter (N-2SC) is likely to occur for rather large $\\eta$, 0.86 $\\leq \\eta \\leq$ 1.1 in the interior of compact stars for Gaussian formfactor. For the two other formfactors the range of the mixed phase is shifted to lower values of $\\eta$. This result leads us to suggest that, if the coupling is not so large, spin-1 channels may be more likely to occur rather than the 2SC phase for intermediate densities in the interior of compact stars.

  17. Time-variability of the coupling constants of fundamental particles and Oklo phenomena

    Energy Technology Data Exchange (ETDEWEB)

    Fujii, Yasunori [Nihon Fukushi Univ., Handa, Aichi (Japan); Iwamoto, Akira; Hidaka, Hiroshi

    2000-09-01

    About 60 years ago, Dirac, P.A.M. presented that gravitational constant was not a constant but varied with a time in universe. As it has not obtained any determining proof experimentally, a fundamental concept on physical constants was disturbed since then, which has been succeeded to trials on the present integral theory. In special, some interesting researches on what is called coupling constants of fundamental particles, such as if fundamental charge of an electron changes actually, are continued. As proof on this change was not established, the observing and experimental upper values contain some important suggestions. The most serious result as its upper limit was obtained as well by an investigation on a surprising fact (a natural reactor) that uranium naturally reached a criticality at a place (Oklo) on the earth two billion years ago. Here were introduced on some their recent researches. (G.K.)

  18. Quantized cosmological constant in 1+1 dimensional quantum gravity with coupled scalar matter

    Energy Technology Data Exchange (ETDEWEB)

    Govaerts, Jan; Zonetti, Simone, E-mail: Jan.Govaerts@uclouvain.be, E-mail: Simone.Zonetti@uclouvain.be [Centre for Cosmology, Particle Physics and Phenomenology (CP3), Institut de Recherche en Mathematique et Physique (IRMP), Universite catholique de Louvain, Chemin du Cyclotron 2, B-1348 Louvain-la Neuve (Belgium)

    2011-09-21

    A two-dimensional matter-coupled model of quantum gravity is studied in the Dirac approach to constrained dynamics in the presence of a cosmological constant. It is shown that after partial fixing to the conformal gauge, the requirement of a quantum realization of the conformal algebra for physical quantum states of the fields naturally constrains the cosmological constant to take values in a well-determined and mostly discrete spectrum. Furthermore, the contribution of the quantum fluctuations of the single dynamical degree of freedom in the gravitational sector, namely the conformal mode, to the cosmological constant is negative, in contrast to the positive contributions of the quantum fluctuations of the matter fields, possibly opening an avenue towards addressing the cosmological constant problem in a more general context.

  19. The variation of the fine-structure constant from disformal couplings

    CERN Document Server

    van de Bruck, Carsten; Nunes, Nelson J

    2015-01-01

    We study a theory in which the electromagnetic field is disformally coupled to a scalar field, in addition to a usual non-minimal electromagnetic coupling. We show that disformal couplings modify the expression for the fine-structure constant, alpha. As a result, the theory we consider can explain the non-zero reported variation in the evolution of alpha by purely considering disformal couplings. We also find that if matter and photons are coupled in the same way to the scalar field, disformal couplings itself do not lead to a variation of the fine-structure constant. A number of scenarios are discussed consistent with the current astrophysical, geochemical, laboratory and the cosmic microwave background radiation constraints on the cosmological evolution of alpha. The models presented are also consistent with the current type Ia supernovae constraints on the effective dark energy equation of state. We find that the Oklo bound in particular puts strong constraints on the model parameters. From our numerical r...

  20. Alleviating the window problem in large volume renormalization schemes

    OpenAIRE

    Korcyl, Piotr

    2017-01-01

    We propose a strategy for large volume non-perturbative renormalization which alleviates the window problem by reducing cut-off effects. We perform a proof-of-concept study using position space renormalization scheme and the CLS $N_f=2+1$ ensembles generated at 5 different lattice spacings. We show that in the advocated strategy results for the renormalization constants are to a large extend independent of the specific lattice direction used to define the renormalization condition. Hence, ver...

  1. Bekenstein model and the time variation of the strong coupling constant

    CERN Document Server

    Chamoun, N; Vucetich, H

    2001-01-01

    We propose to generalize Bekenstein model for the time variation of the fine structure "constant" $\\alpha_{em}$ to QCD strong coupling constant $\\alpha_S$. We find that, except for a ``fine tuned'' choice of the free parameters, the extension can not be performed trivially without being in conflict with experimental constraints and this rules out $\\alpha_S$ variability. This is due largely to the huge numerical value of the QCD vacuum gluon condensate when compared to the mass density of the universe.

  2. Sensitivity-enhanced Experiments for the Measurement of J and Dipolar Coupling Constants

    Institute of Scientific and Technical Information of China (English)

    LIN,Dong-Hai(林东海); LIAO,Xin-Li(廖新丽)

    2002-01-01

    A sensitivity-enhanced IPAP NMR experiment was described in this paper, which separates the 1H-15N doublets into two different spectra to alleviate the problem of resonance overlaps and achieve the accurate measurement of J and residual dipolar coupling constants in proteins. This experiment offered 20%-60% sensitivity enhancement over the original IPAP experiment, and therefore produced more measurable resonances.Pulsed field gradient was used for coherence selection. Water-flip-back approach was used for water suppression. The sensitivity-enhanced IPAP experiment was employed in the measurement of 1JNH and 1DNH constants of the protein UBC9.

  3. Study of coupled-cluster correlations on electromagnetic transitions and hyperfine structure constants of W VI

    CERN Document Server

    Bhowmik, Anal; Roy, Sourav; Majumder, Sonjoy

    2016-01-01

    This work presents precise calculations of important electromagnetic transition amplitudes along with detail of their many-body correlations using relativistic coupled cluster method. Studies of hyperfine interaction constants, useful for plasma diagnostic, with this correlation exhaustive many-body approach are another important area of this work. The calculated oscillator strengths of allowed transitions, amplitudes of forbidden transitions and lifetimes are compared with the other theoretical results wherever available and they show a good agreement. Hyperfine constants of ?different isotopes of W VI, presented in this paper will be helpful to get accurate picture of abundances of this element in different astronomical bodies.

  4. Transport in a gravity dual with a varying gravitational coupling constant

    CERN Document Server

    García-García, Antonio M; Romero-Bermúdez, Aurelio

    2016-01-01

    We study asymptotically AdS Brans-Dicke (BD) backgrounds, where the Ricci tensor R is coupled to a scalar in the radial dimension, as effective models of metals with a varying coupling constant. We show that, for translational invariant backgrounds, the dc conductivity deviates from the universal result of Einstein-Maxwell-Dilaton (EMD) models. However, the shear viscosity to entropy ratio saturates the Kovtun-Son-Starinet (KSS) bound. Similar results apply to more general f(R) gravity models. In four bulk dimensions we study momentum relaxation induced by gravitational and electromagnetic axion-dependent couplings. For sufficiently strong momentum dissipation induced by the former, a recently proposed bound on the dc conductivity is violated for any finite electromagnetic axion coupling. Interestingly, in more than four bulk dimensions, the dc conductivity for strong momentum relaxation decreases with temperature in the low temperature limit. In line with other gravity backgrounds with momentum relaxation, t...

  5. Renormalization Flow of QED

    Science.gov (United States)

    Gies, Holger; Jaeckel, Joerg

    2004-09-01

    We investigate textbook QED in the framework of the exact renormalization group. In the strong-coupling region, we study the influence of fluctuation-induced photonic and fermionic self-interactions on the nonperturbative running of the gauge coupling. Our findings confirm the triviality hypothesis of complete charge screening if the ultraviolet cutoff is sent to infinity. Though the Landau pole does not belong to the physical coupling domain owing to spontaneous chiral-symmetry-breaking (χSB), the theory predicts a scale of maximal UV extension of the same order as the Landau pole scale. In addition, we verify that the χSB phase of the theory which is characterized by a light fermion and a Goldstone boson also has a trivial Yukawa coupling.

  6. Nuclear Density-Dependent Effective Coupling Constants in the Mean-Field Theory

    CERN Document Server

    Lee, J H; Lee, S J; Lee, Jae Hwang; Lee, Young Jae; Lee, Suk-Joon

    1996-01-01

    It is shown that the equation of state of nuclear matter can be determined within the mean-field theory of $\\sigma \\omega$ model provided only that the nucleon effective mass curve is given. We use a family of the possible nucleon effective mass curves that reproduce the empirical saturation point in the calculation of the nuclear binding energy curves in order to obtain density-dependent effective coupling constants. The resulting density-dependent coupling constants may be used to study a possible equation of state of nuclear system at high density or neutron matter. Within the constraints used in this paper to $M^*$ of nuclear matter at saturation point and zero density, neutron matter of large incompressibility is strongly bound at high density while soft neutron matter is weakly bound at low density. The study also exhibits the importance of surface vibration modes in the study of nuclear equation of state.

  7. Compactifications of F-Theory on Calabi-Yau Threefolds at Constant Coupling

    CERN Document Server

    Ahn, C; Ahn, Changhyun; Nam, Soonkeon

    1998-01-01

    Generalizing the work of Sen, we analyze special points in the moduli space of the compactification of the F-theory on elliptically fibered Calabi-Yau threefolds where the coupling remains constant. These contain points where they can be realized as orbifolds of six torus $T^6$ by $Z_m \\times Z_n (m, n=2, 3, 4, 6)$. At various types of intersection points of singularities, we find that the enhancement of gauge symmetries arises from the intersection of two kinds of singularities. We also argue that when we take the Hirzebruch surface as a base for the Calabi-Yau threefold, the condition for constant coupling corresponds to the case where the point like instantons coalesce, giving rise to enhanced gauge group of $Sp(k)$.

  8. On the configuration of five-membered rings: a spin-spin coupling constant approach.

    Science.gov (United States)

    Napolitano, José G; Gavín, José A; García, Celina; Norte, Manuel; Fernández, José J; Daranas, Antonio Hernández

    2011-05-27

    Five-membered rings are clearly among the most common structural motifs found in chemistry and biology. Nevertheless, the configuration of conformationally mobile five-membered rings is often difficult to assign from nuclear magnetic resonance (NMR) data. A simple, reliable, and efficient approach for the stereochemical analysis of five-membered rings based on the measurement of NMR coupling constants is presented. Density functional theory calculations using representative conformations of the full conformational space available to rings with different substitution patterns were used to identify differences between the accessible coupling constant values for cis and trans relative orientations of the substituents. The calculations were assessed experimentally using NMR data obtained from a number of models. This approach can be easily used to analyze different five-membered rings, such as oxolanes, cyclopentanes, furanosides and pyrrolidines, and their relative configuration can be determined without the need for making further conformational considerations.

  9. S3 HMBC hetero: Spin-State-Selective HMBC for accurate measurement of long-range heteronuclear coupling constants

    Science.gov (United States)

    Hoeck, Casper; Gotfredsen, Charlotte H.; Sørensen, Ole W.

    2017-02-01

    A novel method, Spin-State-Selective (S3) HMBC hetero, for accurate measurement of heteronuclear coupling constants is introduced. The method extends the S3 HMBC technique for measurement of homonuclear coupling constants by appending a pulse sequence element that interchanges the polarization in 13C-1H methine pairs. This amounts to converting the spin-state selectivity from 1H spin states to 13C spin states in the spectra of long-range coupled 1H spins, allowing convenient measurement of heteronuclear coupling constants similar to other S3 or E.COSY-type methods. As usual in this type of techniques, the accuracy of coupling constant measurement is independent of the size of the coupling constant of interest. The merits of the new method are demonstrated by application to vinyl acetate, the alkaloid strychnine, and the carbohydrate methyl β-maltoside.

  10. A Time Varying Strong Coupling Constant as a Model of Inflationary Universe

    CERN Document Server

    Chamoun, N; Vucetich, H

    2000-01-01

    We consider a scenario where the strong coupling constant was changing in the early universe. We attribute this change to a variation in the colour charge within a Bekenstein-like model. Allowing for a large value for the vacuum gluon condensate $\\sim 10^{22}GeV^4$, we could generate inflation with the required properties to solve the fluctuation and other standard cosmology problems. A possible approach to end the inflation is suggested.

  11. Limits on the variability of coupling constants from the Oklo natural reactor

    Science.gov (United States)

    Irvine, J. M.

    1983-12-01

    The theoretical basis of prehistoric natural nuclear reactors is summarized and the natural reactor at Oklo in Gabon is discussed. An analysis of isotopic abundances at the Oklo site suggests that the extremely narrow neutron capture resonance in Sm-149 has moved by less than 0.01 eV in the past two billion years. This result is used to place limits on the variability of coupling constants over this period.

  12. Parity-violating $\\pi NN$ coupling constant from the flavor-conserving effective weak chiral Lagrangian

    CERN Document Server

    Hyun, Chang Ho; Lee, Hee-Jung

    2016-01-01

    We investigate the parity-violating pion-nucleon-nucleon coupling constant $h^1_{\\pi NN}$, based on the chiral quark-soliton model. We employ an effective weak Hamiltonian that takes into account the next-to-leading order corrections from QCD to the weak interactions at the quark level. Using the gradient expansion, we derive the leading-order effective weak chiral Lagrangian with the low-energy constants determined. The effective weak chiral Lagrangian is incorporated in the chiral quark-soliton model to calculate the parity-violating $\\pi NN$ constant $h^1_{\\pi NN}$. We obtain a value of about $10^{-7}$ at the leading order. The corrections from the next-to-leading order reduce the leading order result by about 20~\\%.

  13. Strong-Coupling $\\phi^4$-Theory in $4- \\epsilon$ Dimensions and Critical Exponents

    OpenAIRE

    Kleinert, Hagen

    1998-01-01

    With the help of variational perturbation theory we continue the renormalization constants $\\phi^4$-theories in $4- \\epsilon$ dimensions to strong bare couplings $g_0$ and find their power behavior in $g_0$, thereby determining all critical exponents without renormalization group techniques.

  14. Renormalized Volume

    CERN Document Server

    Gover, A Rod

    2016-01-01

    For any conformally compact manifold with hypersurface boundary we define a canonical renormalized volume functional and compute an explicit, holographic formula for the corresponding anomaly. For the special case of asymptotically Einstein manifolds, our method recovers the known results. The anomaly does not depend on any particular choice of regulator, but the coefficients of divergences do. We give explicit formulae for these divergences valid for any choice of regulating hypersurface; these should be relevant to recent studies of quantum corrections to entanglement entropies. The anomaly is expressed as a conformally invariant integral of a local Q-curvature that generalizes the Branson Q-curvature by including data of the embedding. In each dimension this canonically defines a higher dimensional generalization of the Willmore energy/rigid string action. We show that the variation of these energy functionals is exactly the obstruction to solving a singular Yamabe type problem with boundary data along the...

  15. Entanglement renormalization.

    Science.gov (United States)

    Vidal, G

    2007-11-30

    We propose a real-space renormalization group (RG) transformation for quantum systems on a D-dimensional lattice. The transformation partially disentangles a block of sites before coarse-graining it into an effective site. Numerical simulations with the ground state of a 1D lattice at criticality show that the resulting coarse-grained sites require a Hilbert space dimension that does not grow with successive RG transformations. As a result we can address, in a quasi-exact way, tens of thousands of quantum spins with a computational effort that scales logarithmically in the system's size. The calculations unveil that ground state entanglement in extended quantum systems is organized in layers corresponding to different length scales. At a quantum critical point, each relevant length scale makes an equivalent contribution to the entanglement of a block.

  16. Constraining axion coupling constants from measuring the Casimir interaction between polarized test bodies

    Science.gov (United States)

    Bezerra, V. B.; Klimchitskaya, G. L.; Mostepanenko, V. M.; Romero, C.

    2016-08-01

    We propose an experiment for measuring the effective Casimir pressure between two parallel silicon carbide (SiC) plates with aligned nuclear spins. The prospective constraints on an axion-neutron coupling constant for both hadronic and grand unified theory (GUT) axions are calculated using the process of one-axion exchange. For this purpose, a general expression for the additional pressure arising between two polarized plates due to the exchange of one axion between their constituent fermions is derived. We demonstrate that only the polarization component perpendicular to the plates contributes to the pressure. The obtained pressure can be both repulsive and attractive depending on whether the polarizations of both plates are unidirectional or directed in opposite directions. It is shown that although the constraints on an axion-electron coupling obtained in the case of magnetized plates are not competitive, the constraints on an axion-neutron coupling found for plates with polarized nuclear spins are of the same order of magnitude as those obtained previously for the GUT axions alone using the process of two-axion exchange. The proposed experiment allows us also to strengthen the presently known constraints on the axion-neutron coupling constants of GUT axions by using both processes of one- and two-axion exchange.

  17. Constraining axion coupling constants from measuring the Casimir interaction between polarized test bodies

    CERN Document Server

    Bezerra, V B; Mostepanenko, V M; Romero, C

    2016-01-01

    We propose an experiment for measuring the effective Casimir pressure between two parallel SiC plates with aligned nuclear spins. The prospective constraints on an axion-neutron coupling constant for both hadronic and GUT axions are calculated using the process of one-axion exchange. For this purpose, a general expression for the additional pressure arising between two polarized plates due to the exchange of one axion between their constituent fermions is derived. We demonstrate that only the polarization component perpendicular to the plates contribute to the pressure. The obtained pressure can be both repulsive and attractive depending on whether the polarizations of both plates are unidirectional or directed in opposite directions. It is shown that although the constraints on an axion-electron coupling obtained in the case of magnetized plates are not competitive, the constraints on an axion-neutron coupling found for plates with polarized nuclear spins are of the same order of magnitude of those obtained ...

  18. Holographic torus entanglement and its renormalization group flow

    Science.gov (United States)

    Bueno, Pablo; Witczak-Krempa, William

    2017-03-01

    We study the universal contributions to the entanglement entropy (EE) of 2 +1 -dimensional and 3 +1 -dimensional holographic conformal field theories (CFTs) on topologically nontrivial manifolds, focusing on tori. The holographic bulk corresponds to anti-de Sitter-soliton geometries. We characterize the properties of these regulator-independent EE terms as a function of both the size of the cylindrical entangling region, and the shape of the torus. In 2 +1 dimensions, in the simple limit where the torus becomes a thin one-dimensional ring, the EE reduces to a shape-independent constant 2 γ . This is twice the EE obtained by bipartitioning an infinite cylinder into equal halves. We study the renormalization group flow of γ by defining a renormalized EE that (1) is applicable to general QFTs, (2) resolves the failure of the area law subtraction, and (3) is inspired by the F-theorem. We find that the renormalized γ decreases monotonically at small coupling when the holographic CFT is deformed by a relevant operator for all allowed scaling dimensions. We also discuss the question of nonuniqueness of such renormalized EEs both in 2 +1 dimensions and 3 +1 dimensions.

  19. gamma. -->. 3. pi. coupling constant, the Goldberger-Treiman relation, vector mesons and the. omega. -->. 3. pi. contact term

    Energy Technology Data Exchange (ETDEWEB)

    Lahiri, A.; Bagchi, B.

    1987-07-01

    The recent experimental measurement of the ..gamma.. ..-->.. 3..pi.. coupling constant is compared with the prediction of an extended PCAC hypothesis. Consistency is then sought between the ..omega..rho..pi.. coupling constant, as obtained from an analogue of the GT relation for vector mesons, and what is predicted by the low-energy theorems.

  20. J(Si,H) Coupling Constants of Activated Si-H Bonds.

    Science.gov (United States)

    Meixner, Petra; Batke, Kilian; Fischer, Andreas; Schmitz, Dominik; Eickerling, Georg; Kalter, Marcel; Ruhland, Klaus; Eichele, Klaus; Barquera-Lozada, José E; Casati, Nicola P M; Montisci, Fabio; Macchi, Piero; Scherer, Wolfgang

    2017-09-18

    We outline in this combined experimental and theoretical NMR study that sign and magnitude of J(Si,H) coupling constants provide reliable indicators to evaluate the extent of the oxidative addition of Si-H bonds in hydrosilane complexes. In combination with experimental electron density studies and MO analyses a simple structure-property relationship emerges: positive J(Si,H) coupling constants are observed in cases where M → L π-back-donation (M = transition metal; L = hydrosilane ligand) dominates. The corresponding complexes are located close to the terminus of the respective oxidative addition trajectory. In contrast negative J(Si,H) values signal the predominance of significant covalent Si-H interactions and the according complexes reside at an earlier stage of the oxidative addition reaction pathway. Hence, in nonclassical hydrosilane complexes such as Cp2Ti(PMe3)(HSiMe3-nCln) (with n = 1-3) the sign of J(Si,H) changes from minus to plus with increasing number of chloro substituents n and maps the rising degree of oxidative addition. Accordingly, the sign and magnitude of J(Si,H) coupling constants can be employed to identify and characterize nonclassical hydrosilane species also in solution. These NMR studies might therefore help to reveal the salient control parameters of the Si-H bond activation process in transition-metal hydrosilane complexes which represent key intermediates for numerous metal-catalyzed Si-H bond activation processes. Furthermore, experimental high-resolution and high-pressure X-ray diffraction studies were undertaken to explore the close relationship between the topology of the electron density displayed by the η(2)(Si-H)M units and their respective J(Si,H) couplings.

  1. Gauge coupling unification in gauge-Higgs grand unification

    Science.gov (United States)

    Yamatsu, Naoki

    2016-04-01

    We discuss renormalization group equations for gauge coupling constants in gauge-Higgs grand unification on five-dimensional Randall-Sundrum warped space. We show that all four-dimensional Standard Model gauge coupling constants are asymptotically free and are effectively unified in SO(11) gauge-Higgs grand unified theories on 5D Randall-Sundrum warped space.

  2. Decomposition of nuclear magnetic resonance spin-spin coupling constants into active and passive orbital contributions.

    Science.gov (United States)

    Gräfenstein, Jürgen; Tuttle, Tell; Cremer, Dieter

    2004-06-01

    The theory of the J-OC-PSP (decomposition of J into orbital contributions using orbital currents and partial spin polarization) method is derived to distinguish between the role of active, passive, and frozen orbitals on the nuclear magnetic resonance (NMR) spin-spin coupling mechanism. Application of J-OC-PSP to the NMR spin-spin coupling constants of ethylene, which are calculated using coupled perturbed density functional theory in connection with the B3LYP hybrid functional and a [7s,6p,2d/4s,2p] basis set, reveal that the well-known pi mechanism for Fermi contact (FC) spin coupling is based on passive pi orbital contributions. The pi orbitals contribute to the spin polarization of the sigma orbitals at the coupling nuclei by mediating spin information between sigma orbitals (spin-transport mechanism) or by increasing the spin information of a sigma orbital by an echo effect. The calculated FC(pi) value of the SSCC (1)J(CC) of ethylene is 4.5 Hz and by this clearly smaller than previously assumed.

  3. Aspects of Galileon non-renormalization

    Energy Technology Data Exchange (ETDEWEB)

    Goon, Garrett [Department of Applied Mathematics and Theoretical Physics, Cambridge University,Wilberforce Road, Cambridge, CB3 0WA (United Kingdom); Hinterbichler, Kurt [Perimeter Institute for Theoretical Physics,31 Caroline St. N, Waterloo, Ontario, N2L 2Y5 (Canada); Joyce, Austin [Enrico Fermi Institute and Kavli Institute for Cosmological Physics, University of Chicago,S. Ellis Avenue, Chicago, IL 60637 (United States); Trodden, Mark [Center for Particle Cosmology, Department of Physics and Astronomy,University of Pennsylvania,S. 33rd Street, Philadelphia, PA 19104 (United States)

    2016-11-18

    We discuss non-renormalization theorems applying to galileon field theories and their generalizations. Galileon theories are similar in many respects to other derivatively coupled effective field theories, including general relativity and P(X) theories. In particular, these other theories also enjoy versions of non-renormalization theorems that protect certain operators against corrections from self-loops. However, we argue that the galileons are distinguished by the fact that they are not renormalized even by loops of other heavy fields whose couplings respect the galileon symmetry.

  4. 2JHH-resolved HSQC: Exclusive determination of geminal proton-proton coupling constants

    Science.gov (United States)

    Marcó, Núria; Nolis, Pau; Gil, Roberto R.; Parella, Teodor

    2017-09-01

    The measurement of two-bond proton-proton coupling constants (2JHH) in prochiral CH2 groups from the F2 dimension of 2D spectra is not easy due to the usual presence of complex multiplet J patterns, line broadening effects and strong coupling artifacts. These drawbacks are particularly pronounced and frequent in AB spin systems, as those normally exhibited by the pair of diastereotopic CH2 protons. Here, a novel 2JHH-resolved HSQC experiment for the exclusive and accurate determination of the magnitude of 2JHH from the doublet displayed along the highly-resolved indirect F1 dimension is described. A pragmatic 2JHH NMR profile affords a fast overview of the full range of existing 2JHH values. In addition, a 2JHH/δ(13C)-scaled version proves to be an efficient solution when severe signal overlapping complicate a rigorous analysis. The performance of the method is compared with other current techniques and illustrated by the determination of challenging residual dipolar 2DHH coupling constants of small molecules dissolved in weakly orienting media.

  5. Renormalization and asymptotic expansion of Dirac's polarized vacuum

    CERN Document Server

    Gravejat, Philippe; Séré, Eric

    2010-01-01

    We perform rigorously the charge renormalization of the so-called reduced Bogoliubov-Dirac-Fock (rBDF) model. This nonlinear theory, based on the Dirac operator, describes atoms and molecules while taking into account vacuum polarization effects. We consider the total physical density including both the external density of a nucleus and the self-consistent polarization of the Dirac sea, but no `real' electron. We show that it admits an asymptotic expansion to any order in powers of the physical coupling constant $\\alphaph$, provided that the ultraviolet cut-off behaves as $\\Lambda\\sim e^{3\\pi(1-Z_3)/2\\alphaph}\\gg1$. The renormalization parameter $0

  6. On the discrepancy between theory and experiment for the F-F spin-spin coupling constant of difluoethyne

    DEFF Research Database (Denmark)

    Faber, Rasmus; Sauer, Stephan P. A.

    2012-01-01

    The vicinal indirect nuclear spin-spin coupling constant (SSCC) between the two ¿uorine atoms in di¿uoroethyne has been reinvestigated. This coupling has previously proved dif¿cult to calculate accurately. In this study we have therefore systematically investigated the dependence of this coupling...

  7. Jet production from the perturbative QCD pomeron with a running coupling constant

    CERN Document Server

    Braun, M; Braun, Mikhail; Vacca, Gian Paolo

    1997-01-01

    An analysis of minijet production from the hard pomeron with a running coupling constant is performed. Two supercritical pomerons found in the numerical study are taken into account. The calculated inclusive jet production rate is finite at small $k_{\\bot}$ and behaves like $1/k^{-4}_{\\bot}$ at high $k_{\\bot}$ modulo factors coming from logarithmic terms. The average $k_{\\bot}$ is found to be very large ($\\sim 10-13 GeV/c$) and practically independent of energy. This is interpreted as an indication that at present energies we are still far from the asymptotics and that, apart from supercritical pomerons, other states contribute significantly.

  8. Measurement of hyperfine coupling constants of muoniated radicals in small molecule semiconductors

    Science.gov (United States)

    Schulz, L.; Wang, K.; Willis, M.; Nuccio, L.; Murahari, P.; Zhang, S.; Pratt, F. L.; Lord, J. S.; Morley, N. A.; Bernhard, C.; Drew, A. J.

    2014-12-01

    We report the hyperfine coupling constants of muoniated radicals formed in a number of organic semiconductors, via transverse field measurements taken in the Paschen Back limit, and compare the results to avoided level crossing resonances. Five muoniated radicals are found in tetracene, despite there only being three potential non-equivalent bonding sites, and we suggest that this might be down to crystal packing effects. For 6,13-bis(triisopropylsilylethynyl) pentacene and 6,13-bis(trimethlsilylethynyl)-pentacene, we demonstrate that the transverse field data supports the previously published avoided level crossing resonances.

  9. Quantum size effects in Pb layers with absorbed Kondo adatoms: Determination of the exchange coupling constant

    KAUST Repository

    Schwingenschlögl, Udo

    2009-07-01

    We consider the magnetic interaction of manganese phtalocyanine (MnPc) absorbed on Pb layers that were grown on a Si substrate. We perform an ab initio calculation of the density of states and Kondo temperature as a function of the number of Pb monolayers. Comparison to experimental data [Y.-S. Fu et al., Phys. Rev. Lett. 99, 256601 (2007)] then allows us to determine the exchange coupling constant J between the spins of the adsorbed molecules and those of the Pb host. This approach gives rise to a general and reliable method for obtaining J by combining experimental and numerical results.

  10. Numerical studies of the ABJM theory for arbitrary N at arbitrary coupling constant

    CERN Document Server

    Hanada, Masanori; Honma, Yoshinori; Nishimura, Jun; Shiba, Shotaro; Yoshida, Yutaka

    2012-01-01

    We show that the ABJM theory, which is a N=6 superconformal U(N)\\times U(N) Chern-Simons gauge theory, can be studied for arbitrary N at arbitrary coupling constant by applying a simple Monte Carlo method to the matrix model that can be derived from the theory by using the localization technique. This opens up the possibility of probing the quantum aspects of M-theory and testing the AdS_4/CFT_3 duality at the quantum level. Here we calculate the free energy, and confirm the N^{3/2} scaling in the M-theory limit predicted from the gravity side. We also find that the previously proposed analytical formula needs to be corrected by an additional term at each order of the string coupling expansion. The method can be easily generalized to the calculations of BPS operators and to other theories that reduce to matrix models.

  11. Transport in a gravity dual with a varying gravitational coupling constant

    Science.gov (United States)

    García-García, Antonio M.; Loureiro, Bruno; Romero-Bermúdez, Aurelio

    2016-10-01

    We study asymptotically AdS Brans-Dicke (BD) backgrounds, where the Ricci tensor R is coupled to a scalar in the radial dimension, as effective models of metals with a varying coupling constant. We show that, for translationally invariant backgrounds, the regular part of the dc conductivity σQ deviates from the universal result of Einstein-Maxwell-dilaton (EMD) models. However, the shear viscosity to entropy ratio saturates the Kovtun-Son-Starinets (KSS) bound. Similar results apply to more general f(R) gravity models. In four bulk dimensions we study momentum relaxation induced by gravitational and electromagnetic axion-dependent couplings. For sufficiently strong momentum dissipation induced by the former, a recently proposed bound on the dc conductivity σ is violated for any finite electromagnetic axion coupling. Interestingly, in more than four bulk dimensions, the dc conductivity for strong momentum relaxation decreases with temperature in the low temperature limit. In line with other gravity backgrounds with momentum relaxation, the shear viscosity to entropy ratio is always lower than the KSS bound. The numerical computation of the optical conductivity reveals a linear growth with the frequency in the limit of low temperature, low frequency and large momentum relaxation. We have also shown that the module and argument of the optical conductivity for intermediate frequencies are not consistent with cuprates' experimental results, even assuming several channel of momentum relaxation.

  12. Determination of {sup 19} F - {sup 13} C coupling constants and their use in mono fluoro benzaldehyde derivatives conformational analysis

    Energy Technology Data Exchange (ETDEWEB)

    Villar, Jose Daniel Figueroa [Instituto Militar de Engenharia (IME), Rio de Janeiro, RJ (Brazil). Inst. de Quimica

    1995-12-31

    The element fluorine is extremely important in medicinal chemistry. In order to research the possible molecular alterations introduced for the substitution of hydrogen for fluorine, the study of {sup 19} F-{sup 13} C coupling constants is necessary. In this work, ortho- and para-fluorine-substituted benzaldehydes and some other aromatic fluoro compounds were studied using {sup 1} H, {sup 13} C and {sup 19} F NMR. The long range C-F coupling constants were measured from the PND spectra and compared with the long range values of H-C coupling constants, so as to, at first, determine their importance in conformational analysis 5 refs., 2 figs., 3 tabs.

  13. A scheme for detecting the atom-field coupling constant in the Dicke superradiation regime using hybrid cavity optomechanical system.

    Science.gov (United States)

    Wang, Yueming; Liu, Bin; Lian, Jinling; Liang, Jiuqing

    2012-04-23

    We proposed a scheme for detecting the atom-field coupling constant in the Dicke superradiation regime based on a hybrid cavity optomechanical system assisted by an atomic gas. The critical behavior of the Dicke model was obtained analytically using the spin-coherent-state representation. Without regard to the dynamics of cavity field an analytical formula of one-to-one correspondence between movable mirror's steady position and atom-field coupling constant for a given number of atoms is obtained. Thus the atom-field coupling constant can be probed by measuring the movable mirror's steady position, which is another effect of the cavity optomechanics. © 2012 Optical Society of America

  14. On Geometric Probability, Holography, Shilov Boundaries and the Four Physical Coupling Constants of Nature

    Directory of Open Access Journals (Sweden)

    Castro C.

    2005-07-01

    Full Text Available By recurring to Geometric Probability methods, it is shown that the coupling constants, αEM; αW; αC associated with Electromagnetism, Weak and the Strong (color force are given by the ratios of the ratios of the measures of the Shilov boundaries Q2=S1×RP1; Q3=S2×RP1; S5, respectively, with respect to the ratios of the measures μ[Q5]/μN[Q5] associated with the 5D conformally compactified real Minkowski spacetime ˉ M5 that has the same topology as the Shilov boundary Q5 of the 5 complex-dimensional poly-disc D5. The homogeneous symmetric complex domain D5=SO(5,2/SO(5×SO(2 corresponds to the conformal relativistic curved 10 real-dimensional phase space H10 associated with a particle moving in the 5D Anti de Sitter space AdS5. The geometric coupling constant associated to the gravitational force can also be obtained from the ratios of the measures involving Shilov boundaries. We also review our derivation of the observed vacuum energy density based on the geometry of de Sitter (Anti de Sitter spaces.

  15. Effect of Hartree-Fock exact exchange on intramolecular magnetic coupling constants of organic diradicals

    Energy Technology Data Exchange (ETDEWEB)

    Cho, Daeheum; Ko, Kyoung Chul; Lee, Jin Yong, E-mail: jinylee@skku.edu [Department of Chemistry, Sungkyunkwan University, Suwon 440-746 (Korea, Republic of); Ikabata, Yasuhiro; Wakayama, Kazufumi; Yoshikawa, Takeshi [Department of Chemistry and Biochemistry, School of Advanced Science and Engineering, Waseda University, 3-4-1 Okubo, Shinjuku-ku, Tokyo 169-8555 (Japan); Nakai, Hiromi, E-mail: nakai@waseda.jp [Department of Chemistry and Biochemistry, School of Advanced Science and Engineering, Waseda University, 3-4-1 Okubo, Shinjuku-ku, Tokyo 169-8555 (Japan); Research Institute for Science and Engineering, Waseda University, 3-4-1 Okubo, Shinjuku-ku, Tokyo 169-8555 (Japan); CREST, Japan Science and Technology Agency, Tokyo 102-0075 (Japan); Elements Strategy Initiative for Catalysts and Batteries (ESICB), Kyoto University, Katsura, Kyoto 615-8520 (Japan)

    2015-01-14

    The intramolecular magnetic coupling constant (J) of diradical systems linked with five- or six-membered aromatic rings was calculated to obtain the scaling factor (experimental J/calculated J ratio) for various density functional theory (DFT) functionals. Scaling factors of group A (PBE, TPSSh, B3LYP, B97-1, X3LYP, PBE0, and BH and HLYP) and B (M06-L, M06, M06-2X, and M06-HF) were shown to decrease as the amount of Hartree-Fock exact exchange (HFx) increases, in other words, overestimation of calculated J becomes more severe as the HFx increases. We further investigated the effect of HFx fraction of DFT functional on J value, spin contamination, and spin density distributions by comparing the B3LYP analogues containing different amount of HFx. It was revealed that spin contamination and spin densities at each atom increases as the HFx increases. Above all, newly developed BLYP-5 functional, which has 5% of HFx, was found to have the scaling factor of 1.029, indicating that calculated J values are very close to that of experimental values without scaling. BLYP-5 has potential to be utilized for accurate evaluation of intramolecular magnetic coupling constant (J) of diradicals linked by five- or six-membered aromatic ring couplers.

  16. Determination of the pion-nucleon coupling constant and scattering lengths

    CERN Document Server

    Ericson, Torleif Eric Oskar; Thomas, A W

    2002-01-01

    We critically evaluate the isovector GMO sum rule for forward pion-nucleon scattering using the recent precision measurements of negatively charged pion-proton and pion-deuteron scattering lengths from pionic atoms. We deduce the charged-pion-nucleon coupling constant, with careful attention to systematic and statistical uncertainties. This determination gives, directly from data a pseudoscalar coupling constant of 14.17+-0.05(statistical)+-0.19(systematic) or a pseudovector one of 0.0786(11). This value is intermediate between that of indirect methods and the direct determination from backward neutron-proton differential scattering cross sections. We also use the pionic atom data to deduce the coherent symmetric and antisymmetric sums of the negatively charged pion-proton and pion-neutron scattering lengths with high precision. The symmetric sum gives 0.0017+-0.0002(statistical)+-0.0008 (systematic) and the antisymmetric one 0.0900+-0.0003(statistical)+-0.0013(systematic), both in units of inverse charged pi...

  17. Two-loop renormalization of vector, axial-vector and tensor fermion bilinears on the lattice

    CERN Document Server

    Skouroupathis, A

    2008-01-01

    We compute the two-loop renormalization functions, in the RI' scheme, of local bilinear quark operators $\\bar{\\psi}\\Gamma\\psi$, where $\\Gamma$ corresponds to the Vector, Axial-Vector and Tensor Dirac operators, in the lattice formulation of QCD. We consider both the flavor nonsinglet and singlet operators. We use the clover action for fermions and the Wilson action for gluons. Our results are given as a polynomial in $c_{SW}$, in terms of both the renormalized and bare coupling constant, in the renormalized Feynman gauge. Finally, we present our results in the MSbar scheme, for easier comparison with calculations in the continuum. The corresponding results, for fermions in an arbitrary representation, together with some special features of superficially divergent integrals, are included in the Appendices.

  18. Aerobic oxidation of methanol to formic acid on Au8-: benchmark analysis based on completely renormalized coupled-cluster and density functional theory calculations.

    Science.gov (United States)

    Hansen, Jared A; Ehara, Masahiro; Piecuch, Piotr

    2013-10-10

    The left-eigenstate completely renormalized coupled-cluster (CC) method with singles, doubles, and noniterative triples [CR-CC(2,3)] and a few representative density functional theory (DFT) approaches have been applied to methanol oxidation to formic acid on a Au8(-) cluster, which is a model for aerobic oxidations on gold nanoparticles. It is demonstrated that CR-CC(2,3) supports the previous exothermic reaction mechanism, placing the initial rate-determining transition state, which corresponds to hydrogen transfer from the methoxy species to the molecular oxygen, at about 20 kcal/mol above the reactants, less than 40 kcal/mol above the O2 and CH3O(-) species coadsorbed on Au8(-), and considerably above the remaining two transition states along the reaction pathway. The DFT calculations using the previously exploited M06 hybrid functional show reasonable agreement with CR-CC(2,3), but B3LYP offers additional improvements in the description of the relevant activation energies. Pure functionals, including M06-L, BP86, and TPSS, do not work well, significantly underestimating the activation barriers, but dispersion corrections, as in B97-D, bring the results closer to the M06 accuracy level.

  19. A calorimetric measurement of the strong coupling constant in electron-positron annihilation at a center-of-mass energy of 91.6 GeV

    Energy Technology Data Exchange (ETDEWEB)

    Martirena, Saul Gonzalez [Stanford Univ., CA (United States)

    1994-04-01

    In this work, a measurement of the strong coupling constant αs in e+e- annihilation at a center-of-mass energy of 91.6 GeV is presented. The measurement was performed with the SLD at the Stanford Linear Collider facility located at the Stanford Linear Accelerator Center in California. The procedure used consisted of measuring the rate of hard gluon radiation from the primary quarks in a sample of 9,878 hadronic events. After defining the asymptotic manifestation of partons as `jets`, various phenomenological models were used to correct for the hadronization process. A value for the QCD scale parameter Λ$\\bar{MS}$, defined in the $\\bar{MS}$ renormalization convention with 5 active quark flavors, was then obtained by a direct fit to O(αs2) calculations. The value of αs obtained was αs (M) = 0.122 ± 0.004 $+0.008\\atop{-0.007}$ where the uncertainties are experimental (combined statistical and systematic) and theoretical (systematic) respectively. Equivalently, Λ$\\bar{MS}$ = 0.28 $+0.16\\atop{0.10}$ GeV where the experimental and theoretical uncertainties have been combined.

  20. A calorimetric measurement of the strong coupling constant in electron-positron annihilation at a center-of-mass energy of 91.6 GeV

    Energy Technology Data Exchange (ETDEWEB)

    Martirena, S.G.

    1994-04-01

    In this work, a measurement of the strong coupling constant {alpha}{sub s} in e{sup +}e{sup {minus}} annihilation at a center-of-mass energy of 91.6 GeV is presented. The measurement was performed with the SLD at the Stanford Linear Collider facility located at the Stanford Linear Accelerator Center in California. The procedure used consisted of measuring the rate of hard gluon radiation from the primary quarks in a sample of 9,878 hadronic events. After defining the asymptotic manifestation of partons as `jets`, various phenomenological models were used to correct for the hadronization process. A value for the QCD scale parameter {Lambda}{sub bar MS}, defined in the {sub bar MS} renormalization convention with 5 active quark flavors, was then obtained by a direct fit to O({alpha}{sub s}{sup 2}) calculations. The value of {alpha}{sub s} obtained was {alpha}{sub s}(M{sub z0}) = 0.122 {plus_minus} 0.004 {sub {minus}0.007} {sup +0.008} where the uncertainties are experimental (combined statistical and systematic) and theoretical (systematic) respectively. Equivalently, {Lambda}{sub bar MS} = 0.28 {sub {minus}0.10}{sup +0.16} GeV where the experimental and theoretical uncertainties have been combined.

  1. Renormalization of the N = 1 Abelian super-Chern-Simons theory coupled to parity-preserving matter

    Energy Technology Data Exchange (ETDEWEB)

    Colatto, L.P.; Andrade, M.A. de; Franco, D.H.T.; Helayel Neto, J.A. [Centro Brasileiro de Pesquisas Fisicas (CBPF), Rio de Janeiro, RJ (Brazil); Del Cima, O.M. [Technische Universitat Wien (Austria). Institut fuer Theoretische Physik; Piguet, O. [Espirito Santo Univ., Vitoria, ES (Brazil). Dept. de Fisica

    1997-12-01

    We analyse the renormalizability of an Abelian N=1 super-Chern-Simons model coupled to parity-preserving matter on the light of the regularization independent algebraic method. The model shows to be stable under radiative corrections and to gauge anomaly free. (author) 7 refs.

  2. Conformational dependence of {sup 13}C shielding and coupling constants for methionine methyl groups

    Energy Technology Data Exchange (ETDEWEB)

    Butterfoss, Glenn L. [New York University, Courant Institute of Mathematical Sciences and the Center for Genomics and Systems Biology (United States); DeRose, Eugene F.; Gabel, Scott A.; Perera, Lalith; Krahn, Joseph M.; Mueller, Geoffrey A.; Zheng Xunhai; London, Robert E., E-mail: London@niehs.nih.go [National Institute of Environmental Health Sciences (NIEHS), NIH, Laboratory of Structural Biology (United States)

    2010-09-15

    Methionine residues fulfill a broad range of roles in protein function related to conformational plasticity, ligand binding, and sensing/mediating the effects of oxidative stress. A high degree of internal mobility, intrinsic detection sensitivity of the methyl group, and low copy number have made methionine labeling a popular approach for NMR investigation of selectively labeled protein macromolecules. However, selective labeling approaches are subject to more limited information content. In order to optimize the information available from such studies, we have performed DFT calculations on model systems to evaluate the conformational dependence of {sup 3}J{sub CSCC}, {sup 3}J{sub CSCH}, and the isotropic shielding, {sigma}{sub iso}. Results have been compared with experimental data reported in the literature, as well as data obtained on [methyl-{sup 13}C]methionine and on model compounds. These studies indicate that relative to oxygen, the presence of the sulfur atom in the coupling pathway results in a significantly smaller coupling constant, {sup 3}J{sub CSCC}/{sup 3}J{sub COCC} {approx} 0.7. It is further demonstrated that the {sup 3}J{sub CSCH} coupling constant depends primarily on the subtended CSCH dihedral angle, and secondarily on the CSCC dihedral angle. Comparison of theoretical shielding calculations with the experimental shift range of the methyl group for methionine residues in proteins supports the conclusion that the intra-residue conformationally-dependent shift perturbation is the dominant determinant of {delta}{sup 13}C{epsilon}. Analysis of calmodulin data based on these calculations indicates that several residues adopt non-standard rotamers characterized by very large {approx}100{sup o} {chi}{sup 3} values. The utility of the {delta}{sup 13}C{epsilon} as a basis for estimating the gauche/trans ratio for {chi}{sup 3} is evaluated, and physical and technical factors that limit the accuracy of both the NMR and crystallographic analyses are

  3. Renormalization: an advanced overview

    NARCIS (Netherlands)

    Gurau, R.; Rivasseau, V.; Sfondrini, A.|info:eu-repo/dai/nl/330983083

    2014-01-01

    We present several approaches to renormalization in QFT: the multi-scale analysis in perturbative renormalization, the functional methods \\`a la Wetterich equation, and the loop-vertex expansion in non-perturbative renormalization. While each of these is quite well-established, they go beyond

  4. Renormalized action improvements

    Energy Technology Data Exchange (ETDEWEB)

    Zachos, C.

    1984-01-01

    Finite lattice spacing artifacts are suppressed on the renormalized actions. The renormalized action trajectories of SU(N) lattice gauge theories are considered from the standpoint of the Migdal-Kadanoff approximation. The minor renormalized trajectories which involve representations invariant under the center are discussed and quantified. 17 references.

  5. How Precisely can we Determine the $\\piNN$ Coupling Constant from the Isovector GMO Sum Rule?

    CERN Document Server

    Loiseau, B; Thomas, A W

    1999-01-01

    The isovector GMO sum rule for zero energy forward pion-nucleon scattering iscritically studied to obtain the charged pion-nucleon coupling constant usingthe precise negatively charged pion-proton and pion-deuteron scattering lengthsdeduced recently from pionic atom experiments. This direct determination leadsto a pseudoscalar charged pion-nucleon coupling constant of 14.23 +- 0.09(statistic) +- 0.17 (systematic). We obtain also accurate values for thepion-nucleon scattering lengths.

  6. Renormalized Volumes with Boundary

    CERN Document Server

    Gover, A Rod

    2016-01-01

    We develop a general regulated volume expansion for the volume of a manifold with boundary whose measure is suitably singular along a separating hypersurface. The expansion is shown to have a regulator independent anomaly term and a renormalized volume term given by the primitive of an associated anomaly operator. These results apply to a wide range of structures. We detail applications in the setting of measures derived from a conformally singular metric. In particular, we show that the anomaly generates invariant (Q-curvature, transgression)-type pairs for hypersurfaces with boundary. For the special case of anomalies coming from the volume enclosed by a minimal hypersurface ending on the boundary of a Poincare--Einstein structure, this result recovers Branson's Q-curvature and corresponding transgression. When the singular metric solves a boundary version of the constant scalar curvature Yamabe problem, the anomaly gives generalized Willmore energy functionals for hypersurfaces with boundary. Our approach ...

  7. Numerical study of renormalization group flows of nuclear effective field theory without pions on a lattice

    CERN Document Server

    Harada, Koji; Yahiro, Masanobu

    2016-01-01

    We formulate the next-to-leading order nuclear effective field theory without pions in the two-nucleon sector on a spatial lattice, and investigate nonperturbative renormalization group flows in the strong coupling region by diagonalizing the Hamiltonian numerically. The cutoff (proportional to the inverse of the lattice constant) dependence of the coupling constants is obtained by changing the lattice constant with the binding energy and the asymptotic normalization constant for the groundstate being fixed. We argue that the critical line can be obtained by looking at the finite-size dependence of the groundstate energy. We determine the relevant operator and locate the nontrivial fixed point, as well as the physical flow line corresponding to the deuteron in the two-dimensional plane of dimensionless coupling constants. It turns out that the location of the nontrivial fixed point is very close to the one obtained by the corresponding analytic calculation, but the relevant operator is quite different.

  8. Determination of the hyperfine coupling constant of cesium 7S1/2 state

    CERN Document Server

    Yang, Guang; Yang, Baodong; Wang, Junmin

    2016-01-01

    We report the hyperfine splitting (HFS) measurement of cesium (Cs) 7S1/2 state by optical-optical double-resonance spectroscopy in the 6S1/2-6P3/2-7S1/2 (852 nm + 1470 nm) ladder-type system. The HFS frequency calibration is performed by employing a phase-type waveguide electro-optic modulator together with a stable confocal Fabry-Perot cavity. From the measured HFS between F"= 3 and F"= 4 manifolds of Cs 7S1/2 state [HFS = 2183.273(37) MHz], we have determined the magnetic dipole hyperfine coupling constant [A = 545.818(09) MHz], which is in good agreement with the previous work but much more accurate.

  9. Hyperon puzzle and the RMF model with scaled hadron masses and coupling constants

    Science.gov (United States)

    Kolomeitsev, E. E.; Maslov, K. A.; Voskresensky, D. N.

    2016-01-01

    The equation of state of cold baryonic matter is studied within a relativistic mean-field model with hadron masses and coupling constants depending on a scalar field. We demonstrate that if the effective nucleon mass stops to decrease with a density increase at densities n > n*> n0, where n0 is the nuclear saturation density, the equation of state stiffens for these densities and the limiting neutron star mass increases. The stabilization of the nucleon mass can be realised if in the equation of motion for the scalar mean-field there appear a term sharply varying in a narrow vicinity of the field value corresponding to the density n*. We show several possible realizations of this mechanism getting sufficiently stiff equations of state. The appearance of hyperons in dense neutron star interiors is accounted for. The obtained equations of state remain sufficiently stiff if the reduction of the ϕ meson mass is incorporated. Thereby, the hyperon puzzle can be resolved.

  10. The derivation of the coupling constant in the new Self Creation Cosmology

    CERN Document Server

    Barber, G A

    2003-01-01

    It has been shown that the new Self Creation Cosmology theory predicts a universe with a total density parameter of one third yet spatially flat, which would appear to accelerate in its expansion. Although requiring a moderate amount of 'cold dark matter' the theory does not have to invoke the hypotheses of inflation, 'dark energy', 'quintessence' or a cosmological constant (dynamical or otherwise) to explain observed cosmological features. The theory also offers an explanation for the observed anomalous Pioneer spacecraft acceleration, an observed spin-up of the Earth and an problematic variation of G observed from analysis of the evolution of planetary longitudes. It predicts identical results as General Relativity in standard experimental tests but three definitive experiments do exist to falsify the theory. In order to match the predictions of General Relativity, and observations in the standard tests, the new theory requires the Brans Dicke omega parameter that couples the scalar field to matter to be -3...

  11. Precision determination of the $\\pi N$ scattering lengths and the charged $\\pi NN$ coupling constant

    CERN Document Server

    Ericson, Torleif Eric Oskar; Thomas, A W

    2000-01-01

    We critically evaluate the isovector GMO sumrule for the charged $\\pi N N$ coupling constant using recent precision data from $\\pi ^-$p and $\\pi^-$d atoms and with careful attention to systematic errors. From the $\\pi ^-$d scattering length we deduce the pion-proton scattering lengths ${1/2}(a_{\\pi ^-p}+a_{\\pi ^-n})=(-20\\pm 6$(statistic)$ \\pm 10$ (systematic))~$\\cdot 10^{-4}m_{\\pi_c}^{-1}$ and ${1/2}(a_{\\pi ^-p}-a_{\\pi ^-n})=(903 \\pm 14)\\cdot 10^{-4}m_{\\pi_c}^{-1}$. From this a direct evaluation gives $g^2_c(GMO) =14.20\\pm 0.07$(statistic)$\\pm 0.13$(systematic) or $f^2_c= 0.0786\\pm 0.0008$.

  12. Relativistic Force Field: Parametrization of (13)C-(1)H Nuclear Spin-Spin Coupling Constants.

    Science.gov (United States)

    Kutateladze, Andrei G; Mukhina, Olga A

    2015-11-01

    Previously, we reported a reliable DU8 method for natural bond orbital (NBO)-aided parametric scaling of Fermi contacts to achieve fast and accurate prediction of proton-proton spin-spin coupling constants (SSCC) in (1)H NMR. As sophisticated NMR experiments for precise measurements of carbon-proton SSCCs are becoming more user-friendly and broadly utilized by the organic chemistry community to guide and inform the process of structure determination of complex organic compounds, we have now developed a fast and accurate method for computing (13)C-(1)H SSCCs. Fermi contacts computed with the DU8 basis set are scaled using selected NBO parameters in conjunction with empirical scaling coefficients. The method is optimized for inexpensive B3LYP/6-31G(d) geometries. The parametric scaling is based on a carefully selected training set of 274 ((3)J), 193 ((2)J), and 143 ((1)J) experimental (13)C-(1)H spin-spin coupling constants reported in the literature. The DU8 basis set, optimized for computing Fermi contacts, which by design had evolved from optimization of a collection of inexpensive 3-21G*, 4-21G, and 6-31G(d) bases, offers very short computational (wall) times even for relatively large organic molecules containing 15-20 carbon atoms. The most informative SSCCs for structure determination, i.e., (3)J, were computed with an accuracy of 0.41 Hz (rmsd). The new unified approach for computing (1)H-(1)H and (13)C-(1)H SSCCs is termed "DU8c".

  13. High magnetic exchange coupling constants: a density functional theory based study of substituted Schlenk diradicals.

    Science.gov (United States)

    Latif, Iqbal A; Hansda, Shekhar; Datta, Sambhu N

    2012-08-23

    The Schlenk diradical has been known since 1915. After a detailed experimental work by Rajca, its magnetic nature has remained more or less unexplored. We have investigated by quantum chemical calculations the nature of magnetic coupling in 11 substituted Schlenk diradicals. Substitution has been considered at the fifth carbon atom of the meta-phenylene moiety. The UB3LYP method has been used to study 12 diradicals including the original one. The 6-311G(d,p) basis set has been employed for optimization of molecular geometry in both singlet and triplet states for each species. The singlet optimization has led to the optimization of the broken-symmetry structure for 10 species including the unsubstituted one. This development makes it possible to carry out further broken symmetry calculations in two ways. The triplet calculation has been done using 6-311++G(d,p) basis set and the optimized triplet geometry in both procedures. The broken symmetry calculations have used the optimized geometries of either the triplet states or the broken symmetry solutions. The first method leads to the prediction of electron paramagnetic resonance (EPR) compatible magnetic exchange coupling constant (J) in the range 517-617 cm(-1). A direct optimization of the broken symmetry geometry gives rise to a lower estimate of J, in the range of 411-525 cm(-1) and compatible with macroscopic Curie studies. The calculated J for the unsubstituted Schlenk diradical is 512 cm(-1) that can be compared with 455 cm(-1) estimated by Rajca. In both cases, introduction of groups with +M and +I effects (Ingold's notation) decreases the J value from that for the unsubstituted Schlenk diradical while -I and -M groups at the same position increases J. These trends have been explained in terms of Hammett constants, atomic spin densities, and dihedral angles.

  14. Forbidden nonunique β decays and effective values of weak coupling constants

    Science.gov (United States)

    Haaranen, M.; Srivastava, P. C.; Suhonen, J.

    2016-03-01

    Forbidden nonunique β decays feature shape functions that are complicated combinations of different nuclear matrix elements and phase-space factors. Furthermore, they depend in a very nontrivial way on the values of the weak coupling constants, gV for the vector part and gA for the axial-vector part. In this work we include also the usually omitted second-order terms in the shape functions to see their effect on the computed decay half-lives and electron spectra (β spectra). As examples we study the fourth-forbidden nonunique ground-state-to-ground-state β- decay branches of 113Cd and 115In using the microscopic quasiparticle-phonon model and the nuclear shell model. A striking new feature that is reported in this paper is that the calculated shape of the β spectrum is quite sensitive to the values of gV and gA and hence comparison of the calculated with the measured spectrum shape opens a way to determine the values of these coupling constants. This article is designed to show the power of this comparison, coined spectrum-shape method (SSM), by studying the two exemplary β transitions within two different nuclear-structure frameworks. While the SSM seems to confine the gV values close to the canonical value gV=1.0 , the values of gA extracted from the half-life data and by the SSM emerge contradictory in the present calculations. This calls for improved nuclear-structure calculations and more measured data to systematically employ SSM for determination of the effective value of gA in the future.

  15. Non-perturbative quark mass renormalization

    CERN Document Server

    Capitani, S.; Luescher, M.; Sint, S.; Sommer, R.; Weisz, P.; Wittig, H.

    1998-01-01

    We show that the renormalization factor relating the renormalization group invariant quark masses to the bare quark masses computed in lattice QCD can be determined non-perturbatively. The calculation is based on an extension of a finite-size technique previously employed to compute the running coupling in quenched QCD. As a by-product we obtain the $\\Lambda$--parameter in this theory with completely controlled errors.

  16. Renormalizing an initial state

    CERN Document Server

    Collins, Hael; Vardanyan, Tereza

    2014-01-01

    The intricate machinery of perturbative quantum field theory has largely been devoted to the 'dynamical' side of the theory: simple states are evolved in complicated ways. This article begins to address this lopsided treatment. Although it is rarely possible to solve for the eigenstates of an interacting theory exactly, a general state and its evolution can nonetheless be constructed perturbatively in terms of the propagators and structures defined with respect to the free theory. The detailed form of the initial state in this picture is fixed by imposing suitable `renormalization conditions' on the Green's functions. This technique is illustrated with an example drawn from inflation, where the presence of nonrenormalizable operators and where an expansion that naturally couples early times with short distances make the ability to start the theory at a finite initial time especially desirable.

  17. Renormalization of Hierarchically Interacting Isotropic Diffusions

    Science.gov (United States)

    den Hollander, F.; Swart, J. M.

    1998-10-01

    We study a renormalization transformation arising in an infinite system of interacting diffusions. The components of the system are labeled by the N-dimensional hierarchical lattice ( N≥2) and take values in the closure of a compact convex set bar D subset {R}^d (d ≥slant 1). Each component starts at some θ ∈ D and is subject to two motions: (1) an isotropic diffusion according to a local diffusion rate g: bar D to [0,infty ] chosen from an appropriate class; (2) a linear drift toward an average of the surrounding components weighted according to their hierarchical distance. In the local mean-field limit N→∞, block averages of diffusions within a hierarchical distance k, on an appropriate time scale, are expected to perform a diffusion with local diffusion rate F ( k) g, where F^{(k)} g = (F_{c_k } circ ... circ F_{c_1 } ) g is the kth iterate of renormalization transformations F c ( c>0) applied to g. Here the c k measure the strength of the interaction at hierarchical distance k. We identify F c and study its orbit ( F ( k) g) k≥0. We show that there exists a "fixed shape" g* such that lim k→∞ σk F ( k) g = g* for all g, where the σ k are normalizing constants. In terms of the infinite system, this property means that there is complete universal behavior on large space-time scales. Our results extend earlier work for d = 1 and bar D = [0,1], resp. [0, ∞). The renormalization transformation F c is defined in terms of the ergodic measure of a d-dimensional diffusion. In d = 1 this diffusion allows a Yamada-Watanabe-type coupling, its ergodic measure is reversible, and the renormalization transformation F c is given by an explicit formula. All this breaks down in d≥2, which complicates the analysis considerably and forces us to new methods. Part of our results depend on a certain martingale problem being well-posed.

  18. First example of a high-level correlated calculation of the indirect spin-spin coupling constants involving tellurium

    DEFF Research Database (Denmark)

    Rusakov, Yury Yu; Krivdin, Leonid B.; Østerstrøm, Freja From;

    2013-01-01

    This paper documents a very first example of a high-level correlated calculation of spin-spin coupling constants involving tellurium taking into account relativistic effects, vibrational corrections and solvent effects for the medium sized organotellurium molecules. The 125Te-1H spin-spin coupling...... of spin-spin coupling constants involving tellurium, was developed. The SOPPA methods show much better performance as compared to 15 those of DFT, if relativistic effects calculated within the ZORA scheme are taken into account. Vibrational and solvent corrections are next to negligible, while...

  19. Benchmarking density-functional theory calculations of NMR shielding constants and spin-rotation constants using accurate coupled-cluster calculations.

    Science.gov (United States)

    Teale, Andrew M; Lutnæs, Ola B; Helgaker, Trygve; Tozer, David J; Gauss, Jürgen

    2013-01-14

    Accurate sets of benchmark nuclear-magnetic-resonance shielding constants and spin-rotation constants are calculated using coupled-cluster singles-doubles (CCSD) theory and coupled-cluster singles-doubles-perturbative-triples [CCSD(T)] theory, in a variety of basis sets consisting of (rotational) London atomic orbitals. The accuracy of the calculated coupled-cluster constants is established by a careful comparison with experimental data, taking into account zero-point vibrational corrections. Coupled-cluster basis-set convergence is analyzed and extrapolation techniques are employed to estimate basis-set-limit quantities, thereby establishing an accurate benchmark data set. Together with the set provided for rotational g-tensors and magnetizabilities in our previous work [O. B. Lutnæs, A. M. Teale, T. Helgaker, D. J. Tozer, K. Ruud, and J. Gauss, J. Chem. Phys. 131, 144104 (2009)], it provides a substantial source of consistently calculated high-accuracy data on second-order magnetic response properties. The utility of this benchmark data set is demonstrated by examining a wide variety of Kohn-Sham exchange-correlation functionals for the calculation of these properties. None of the existing approximate functionals provide an accuracy competitive with that provided by CCSD or CCSD(T) theory. The need for a careful consideration of vibrational effects is clearly illustrated. Finally, the pure coupled-cluster results are compared with the results of Kohn-Sham calculations constrained to give the same electronic density. Routes to future improvements are discussed in light of this comparison.

  20. One Loop Renormalization of the Littlest Higgs Model

    CERN Document Server

    Grinstein, Benjamin; Uttayarat, Patipan

    2011-01-01

    In Little Higgs models a collective symmetry prevents the Higgs from acquiring a quadratically divergent mass at one loop. This collective symmetry is broken by weakly gauged interactions. Terms, like Yukawa couplings, that display collective symmetry in the bare Lagrangian are generically renormalized into a sum of terms that do not respect the collective symmetry except possibly at one renormalization point where the couplings are related so that the symmetry is restored. We study here the one loop renormalization of a prototypical example, the Littlest Higgs Model. Some features of the renormalization of this model are novel, unfamiliar form similar chiral Lagrangian studies.

  1. A microscopic particle-vibration coupling approach for atomic nuclei. Giant resonance properties and the renormalization of the effective interaction

    CERN Document Server

    Brenna, Marco

    2014-01-01

    The self-consistent mean-field (SCMF) theory describes many properties of the ground state and excited states of the atomic nucleus, such as masses, radii, deformations and giant resonance energies. SCMF models are based on the independent particle picture where nucleons are assumed to move in a self-generated average potential. In the first part of this work, we apply a state-of-the-art SCMF approach, based on the Skyrme effective interaction, to two different excitations (viz. the pygmy dipole resonance and the isovector giant quadrupole resonance), investigating their relation with the nuclear matter symmetry energy, which corresponds to the energy cost for changing protons into neutrons and is a key parameter for the nuclear equation of state. However, SCMF models present well known limitations which require the inclusion of further dynamical correlations, e.g. the ones coming from the interweaving between single-particle and collective degrees of freedom (particle-vibration coupling - PVC). In the second...

  2. S3 HMBC: Spin-State-Selective HMBC for accurate measurement of homonuclear coupling constants. Application to strychnine yielding thirteen hitherto unreported JHH

    DEFF Research Database (Denmark)

    Kjaerulff, Louise; Benie, Andrew J.; Hoeck, Casper

    2016-01-01

    A novel method, Spin-State-Selective (S3) HMBC, for accurate measurement of homonuclear coupling constants is introduced. As characteristic for S3 techniques, S3 HMBC yields independent subspectra corresponding to particular passive spin states and thus allows determination of coupling constants ...... are demonstrated by an application to strychnine where thirteen JHH coupling constants not previously reported could be measured....

  3. SOPPA and CCSD vibrational corrections to NMR indirect spin-spin coupling constants of small hydrocarbons

    DEFF Research Database (Denmark)

    Faber, Rasmus; Sauer, Stephan P. A.

    2015-01-01

    are in the order of 5 Hz for the one-bond carbon-hydrogen couplings and about 1 Hz or smaller for the other couplings apart from the one-bond carbon-carbon coupling (11 Hz) and the twobond carbon-hydrogen coupling (4 Hz) in ethyne. However, not for all couplings lead the inclusion of zero-point vibrational...

  4. Lectures on the functional renormalization group method

    CERN Document Server

    Polonyi, J

    2001-01-01

    These introductory notes are about functional renormalization group equations and some of their applications. It is emphasised that the applicability of this method extends well beyond critical systems, it actually provides us a general purpose algorithm to solve strongly coupled quantum field theories. The renormalization group equation of F. Wegner and A. Houghton is shown to resum the loop-expansion. Another version, due to J. Polchinski, is obtained by the method of collective coordinates and can be used for the resummation of the perturbation series. The genuinely non-perturbative evolution equation is obtained in a manner reminiscent of the Schwinger-Dyson equations. Two variants of this scheme are presented where the scale which determines the order of the successive elimination of the modes is extracted from external and internal spaces. The renormalization of composite operators is discussed briefly as an alternative way to arrive at the renormalization group equation. The scaling laws and fixed poin...

  5. Towards Holographic Renormalization of Fake Supergravity

    CERN Document Server

    Borodatchenkova, Natalia; Mueck, Wolfgang

    2008-01-01

    A step is made towards generalizing the method of holographic renormalization to backgrounds which are not asymptotically AdS, corresponding to a dual gauge theory which has logarithmically running couplings even in the ultraviolet. A prime example is the background of Klebanov-Strassler (KS). In particular, a recipe is given how to calculate renormalized two-point functions for the operators dual to the bulk scalars. The recipe makes use of gauge-invariant variables for the fluctuations around the background and works for any bulk theory of the fake supergravity type. It elegantly incorporates the renormalization scheme dependence of local terms in the correlators. Before applying the method to the KS theory, it is verified that known results in asymptotically AdS backgrounds are reproduced. Finally, some comments on the calculation of renormalized vacuum expectation values are made.

  6. Entanglement Renormalization and Wavelets.

    Science.gov (United States)

    Evenbly, Glen; White, Steven R

    2016-04-08

    We establish a precise connection between discrete wavelet transforms and entanglement renormalization, a real-space renormalization group transformation for quantum systems on the lattice, in the context of free particle systems. Specifically, we employ Daubechies wavelets to build approximations to the ground state of the critical Ising model, then demonstrate that these states correspond to instances of the multiscale entanglement renormalization ansatz (MERA), producing the first known analytic MERA for critical systems.

  7. Renormalization: an advanced overview

    CERN Document Server

    Gurau, Razvan; Sfondrini, Alessandro

    2014-01-01

    We present several approaches to renormalization in QFT: the multi-scale analysis in perturbative renormalization, the functional methods \\`a la Wetterich equation, and the loop-vertex expansion in non-perturbative renormalization. While each of these is quite well-established, they go beyond standard QFT textbook material, and may be little-known to specialists of each other approach. This review is aimed at bridging this gap.

  8. Determination of the hyperfine coupling constant of the cesium 7S1/2 state

    Science.gov (United States)

    Yang, Guang; Wang, Jie; Yang, Baodong; Wang, Junmin

    2016-08-01

    We report the hyperfine splitting (HFS) measurement of the cesium (Cs) 7S1/2 state by optical-optical double-resonance spectroscopy with the Cs 6S1/2-6P3/2-7S1/2 (852 nm  +  1470 nm) ladder-type system. The HFS frequency calibration is performed by employing a phase-type waveguide electro-optic modulator together with a stable confocal Fabry-Perot cavity. From the measured HFS between the F″  =  3 and F″  =  4 manifolds of the Cs 7S1/2 state (HFS  =  2183.273  ±  0.062 MHz), we have determined the magnetic dipole hyperfine coupling constant (A  =  545.818  ±  0.016 MHz), which is in good agreement with the previous work but much more precise.

  9. The quasi-magnetic-hysteresis behavior of polydisperse ferrofluids with small coupling constant

    Energy Technology Data Exchange (ETDEWEB)

    Li Jian, E-mail: aizhong@swu.edu.cn [School of Physical Science and Technology, Southwest University, Chongqing 400715 (China); Lin Yueqiang; Liu Xiaodong; Lin Lihua; Zhang Qingmei; Fu Jun; Chen Longlong [School of Physical Science and Technology, Southwest University, Chongqing 400715 (China); Li Decai [School of Mechanical and Control Engineering, Beijing Jiaotong University, Beijing 100044 (China)

    2012-12-15

    The magnetization behaviors of ferrofluids based on {gamma}-Fe{sub 2}O{sub 3}/Ni{sub 2}O{sub 3} composite nanoparticles of size about 11 nm have been investigated. The dipole coupling constant {lambda} of these particles is so small (0.43) that they cannot form aggregates through magnetic interaction alone. Experimental results have shown that for a polydisperse ferrofluid with a particle volume fraction of {phi}{sub V}=2.4%, the magnetization curve exhibits quasi-magnetic-hysteresis behavior, i.e., the demagnetization curve lies above the magnetization curve in a high field. However, for a more dilute {gamma}-Fe{sub 2}O{sub 3}/Ni{sub 2}O{sub 3} ferrofluid with {phi}{sub V}=0.94%, the magnetization curve does not show such behavior. According to the bidisperse model for polydisperse ferrofluids, these magnetization behaviors may be attributed to field-induced effects of self-assembled pre-existing chain-like aggregates. For such pre-existing chain-like aggregates, the orientation of the moments inside the particles is not co-linear, so that during the magnetization and demagnetization processes, their apparent magnetizations at the high-field limit are different. As a consequence, the magnetization curve of the ferrofluid with {phi}{sub V}=2.4% displays quasi-magnetic-hysteresis.

  10. Measurement of jet production with the ATLAS detector and extraction of the strong coupling constant

    CERN Document Server

    Sawyer, Lee; The ATLAS collaboration

    2017-01-01

    The production of jets at hadron colliders provides a stringent test of perturbative QCD at the highest energies. The process can also be used to probe the gluon density function of the proton. Specific topologies can be used to extract the strong coupling constant. The ATLAS collaboration has recently measured the inclusive jet production cross section in data collected at a center-of-mass energy of 8TeV and 13TeV. The measurements have been performed differentially in jet rapidity and transverse momentum. The collaboration also presents a first measurement of the di-jet cross section at a center-of-mass energy of 13TeV as a function of the di-jet mass and rapidity. The results have been compared with state-of-the-art theory predictions at NLO in pQCD, interfaced with different parton distribution functions and can be used to constrain the proton structure. We also present new measurements of transverse energy-energy correlations (TEEC) and their associated asymmetries (ATEEC) in multi-jet events at a center...

  11. NMR spin-spin coupling constants in polymethine dyes as polarity indicators.

    Science.gov (United States)

    Murugan, N Arul; Aidas, Kestutis; Kongsted, Jacob; Rinkevicius, Zilvinas; Ågren, Hans

    2012-09-10

    Herein, we explore the use of spin-spin coupling constants (SSCCs) in merocyanine (MCYNE) dyes as indicators of polarity. For this purpose, we use Car-Parrinello hybrid quantum mechanics/molecular mechanics (QM/MM) to determine the structures of MCYNE in solvents of different polarity, followed by computations of the SSCCs by using QM/MM linear-response theory. The molecular geometry of MCYNE switches between neutral, cyanine-like, and zwitterionic depending on the polarity of the solvent. This structural variation is clearly reflected in the proton SSCCs in the polymethine backbone, which are highly sensitive to the dielectric nature of the environment; this mechanism can be used as a "polarity indicator" for different microenvironments. This result is highlighted by computing the SSCCs of the MCYNE probe in the cavity of the beta-lactoglobulin protein. The computed SSCCs clearly indicate a non-polar hydrophobic dielectric nature of this cavity. Copyright © 2012 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  12. Hyperon puzzle and the RMF model with scaled hadron masses and coupling constants

    CERN Document Server

    Kolomeitsev, E E; Voskresensky, D N

    2015-01-01

    The equation of state of cold baryonic matter is studied within a relativistic mean-field model with hadron masses and coupling constants depending on a scalar field. We demonstrate that if the effective nucleon mass stops to decrease with a density increase at densities $n>n_*>n_0$, where $n_0$ is the nuclear saturation density, the equation of state stiffens for these densities and the limiting neutron star mass increases. The stabilization of the nucleon mass can be realised if in the equation of motion for the scalar mean-field there appear a term sharply varying in a narrow vicinity of the field value corresponding to the density $n_*$. We show several possible realizations of this mechanism getting sufficiently stiff equations of state. The appearance of hyperons in dense neutron star interiors is accounted for. The obtained equations of state remain sufficiently stiff if the reduction of the $\\phi$ meson mass is incorporated. Thereby, the hyperon puzzle can be resolved.

  13. The ATLAS Measurements of Jet Production and the Strong Coupling Constant

    CERN Document Server

    Sawyer, Lee; The ATLAS collaboration

    2017-01-01

    The production of jets at hadron colliders provides a stringent test of perturbative QCD at the highest energies. The process can also be used to probe the gluon density in the parton distribution function of the proton. Specific topologies can be used to extract the strong coupling constant. The ATLAS collaboration has recently measured the inclusive jet production cross section in data collected at a center-of-mass energy of 8 TeV and 13 TeV. The measurements have been performed differentially in jet rapidity and transverse momentum. The collaboration also presents a first measurement of the dijet cross section at a center-of-mass energy of 13 TeV as a function of the dijet invariant mass and rapidity. The results have been compared with state-of-the-art theory predictions at NLO in pQCD, interfaced with different parton distribution functions and can be used to constrain the proton structure. We also present new measurements of transverse energy-energy correlations (TEEC) and their associated asymmetries (...

  14. Cluster functional renormalization group

    Science.gov (United States)

    Reuther, Johannes; Thomale, Ronny

    2014-01-01

    Functional renormalization group (FRG) has become a diverse and powerful tool to derive effective low-energy scattering vertices of interacting many-body systems. Starting from a free expansion point of the action, the flow of the RG parameter Λ allows us to trace the evolution of the effective one- and two-particle vertices towards low energies by taking into account the vertex corrections between all parquet channels in an unbiased fashion. In this work, we generalize the expansion point at which the diagrammatic resummation procedure is initiated from a free UV limit to a cluster product state. We formulate a cluster FRG scheme where the noninteracting building blocks (i.e., decoupled spin clusters) are treated exactly, and the intercluster couplings are addressed via RG. As a benchmark study, we apply our cluster FRG scheme to the spin-1/2 bilayer Heisenberg model (BHM) on a square lattice where the neighboring sites in the two layers form the individual two-site clusters. Comparing with existing numerical evidence for the BHM, we obtain reasonable findings for the spin susceptibility, the spin-triplet excitation energy, and quasiparticle weight even in coupling regimes close to antiferromagnetic order. The concept of cluster FRG promises applications to a large class of interacting electron systems.

  15. Exact renormalization of the photino mass in softly broken N = 1 SQED with N f flavors regularized by higher derivatives

    Science.gov (United States)

    Nartsev, I. V.; Stepanyantz, K. V.

    2017-04-01

    We consider the softly broken N = 1 supersymmetric electrodynamics, regularized by higher derivatives. For this theory we demonstrate that the renormalization of the photino mass is determined by integrals of double total derivatives in the momentum space in all orders. Consequently, it is possible to derive the NSVZ-like exact relation between the photino mass anomalous dimension and the anomalous dimension of the matter superfields in the rigid theory by direct summation of supergraphs. It is important that both these renormalization group functions are defined in terms of the bare coupling constant, so that the considered NSVZ-like relation is valid independently of the subtraction scheme in the case of using the higher derivative regularization. The factorization of integrals defining the photino mass renormalization into integrals of double total derivatives is verified by an explicit two-loop calculation.

  16. Strong decay widths and coupling constants of recent charm meson states

    Energy Technology Data Exchange (ETDEWEB)

    Batra, Meenakshi; Upadhayay, Alka [Thapar University, School of Physics and Material Science, Patiala (India)

    2015-07-15

    Open charm hadrons with strange and non-strange mesons have been discovered in recent years. We study the spectra of several newly observed resonances by different collaborations like BaBar (del Amo Sanchez et al., Phys Rev D 82:111101, 2010) and LHCb (Aaij et al. [LHCb Collaboration], J High Energy Phys 1309:145, 2013) etc. Using an effective Lagrangian approach based on heavy quark symmetry and chiral dynamics, we explore the strong decay widths and branching ratios of various resonances and suggest their J{sup p} values. We try to fit the experimental data to find the coupling constants involved in the strong decays through pseudo-scalar mesons. The present work also discusses the possible spin-parity assignments of recently observed states by the LHCb Collaboration. The tentative assignment of the newly discovered state D{sub J}{sup *}(3000) can be by natural parity states (0{sup +},1{sup -},2{sup +},3{sup -},..), while D{sub J}(3000) can be identified with unnatural parity states like (0{sup +},1{sup -},2{sup +},3{sup -},..). Therefore, the missing doublets 2S, 2D, 1F, 2P, and 3S can be thought of as filled up with these states. We study the two-body strong decay widths and branching ratios of missing doublets and plot the branching ratios vs. the mass of the decaying particle. These plots are used to thoroughly analyze all assignments to D{sub J}(3000) and various possibilities for the J{sup p} values. (orig.)

  17. Chiral symmetry effect on the pion-nucleon coupling constant; O efeito da simetria quiral na constante de acoplamento pion-nucleon

    Energy Technology Data Exchange (ETDEWEB)

    Araujo, Vanilse da Silva

    1997-12-31

    In this work we study the effects of chiral symmetry in the pion-nucleon coupling constant in the context of the linear {sigma}- model. First, we introduce the linear {sigma}-model and we discuss the phenomenological hypothesis of CVC and PCAC. Next, we calculate the coupling constant g+{pi}{sub NN}(q{sup 2}) and the nucleon pionic mean square radius considering the contribution of all the diagrams up to one-loop in the framework of the linear {sigma}-model for different values of the mass of the sigma meson and we compare them with the phenomenological form factors. Finally we make an extension of the linear {sigma}-model that consists of taking into account the mass differences of ions and nucleons into the Lagrangian of the model, to study the change dependence of g{sub {pi}nn} (q{sup 2}) and of the mean square radius. (author) 21 refs., 17 figs., 4 tabs.

  18. Summation of Higher Order Effects using the Renormalization Group Equation

    CERN Document Server

    Elias, V; Sherry, T N

    2004-01-01

    The renormalization group (RG) is known to provide information about radiative corrections beyond the order in perturbation theory to which one has calculated explicitly. We first demonstrate the effect of the renormalization scheme used on these higher order effects determined by the RG. Particular attention is payed to the relationship between bare and renormalized quantities. Application of the method of characteristics to the RG equation to determine higher order effects is discussed, and is used to examine the free energy in thermal field theory, the relationship between the bare and renormalized coupling and the effective potential in massless scalar electrodynamics.

  19. High statistics determination of the strong coupling constant in Taylor scheme and its OPE Wilson coefficient from lattice QCD with a dynamical charm

    CERN Document Server

    Blossier, B; Brinet, M; De Soto, F; Morenas, V; Pène, O; Petrov, K; Rodríguez-Quintero, J

    2014-01-01

    This paper reports on the determination of $\\alpha_S$ from lattice simulations with 2+1+1 twisted-mass dynamical flavours {\\it via} the computation of the ghost-gluon coupling renormalized in the MOM Taylor scheme. A high-statistics sample of gauge configurations, used to evaluate the coupling from ghost and gluon propagators, allows for the appropriate update of previous results, now performing an improved analysis of data with reduced statistical errors and the systematical uncertainties under a better control.

  20. Renormalization and effective lagrangians

    Science.gov (United States)

    Polchinski, Joseph

    1984-01-01

    There is a strong intuitive understanding of renormalization, due to Wilson, in terms of the scaling of effective lagrangians. We show that this can be made the basis for a proof of perturbative renormalization. We first study renormalizability in the language of renormalization group flows for a toy renormalization group equation. We then derive an exact renormalization group equation for a four-dimensional λø 4 theory with a momentum cutoff. We organize the cutoff dependence of the effective lagrangian into relevant and irrelevant parts, and derive a linear equation for the irrelevant part. A lengthy but straightforward argument establishes that the piece identified as irrelevant actually is so in perturbation theory. This implies renormalizability. The method extends immediately to any system in which a momentum-space cutoff can be used, but the principle is more general and should apply for any physical cutoff. Neither Weinberg's theorem nor arguments based on the topology of graphs are needed.

  1. Renormalization for Philosophers

    CERN Document Server

    Butterfield, Jeremy

    2014-01-01

    We have two aims. The main one is to expound the idea of renormalization in quantum field theory, with no technical prerequisites (Sections 2 and 3). Our motivation is that renormalization is undoubtedly one of the great ideas, and great successes, of twentieth-century physics. Also it has strongly influenced in diverse ways, how physicists conceive of physical theories. So it is of considerable philosophical interest. Second, we will briefly relate renormalization to Ernest Nagel's account of inter-theoretic relations, especially reduction (Section 4). One theme will be a contrast between two approaches to renormalization. The old approach, which prevailed from ca. 1945 to 1970, treated renormalizability as a necessary condition for being an acceptable quantum field theory. On this approach, it is a piece of great good fortune that high energy physicists can formulate renormalizable quantum field theories that are so empirically successful. But the new approach to renormalization (from 1970 onwards) explains...

  2. Experimental and theoretical investigation of 1J(CC) and (n)J(CC) coupling constants in strychnine.

    Science.gov (United States)

    Williamson, R Thomas; Buevich, Alexei V; Martin, Gary E

    2012-10-05

    A relatively unexplored and unexploited means of establishing molecular structure, stereochemistry, and probing vicinal bond angles is through the use of long-range (13)C-(13)C coupling constants. The measurement of these multifunctional, diagnostic (3)J(CC) couplings has not been reported on sample amounts viable for the practicing organic chemist. A generalized protocol for the measurement of (1)J(CC) and (3)J(CC) couplings using a 4.6 mg sample of strychnine as a model compound is described, and the utility of DFT calculations for the prediction of these useful molecular descriptors and the congruence of the calculated and experimental data is demonstrated.

  3. The Yang-Mills gradient flow and renormalization

    CERN Document Server

    Ramos, Alberto

    2015-01-01

    In this proceedings contribution we will review the main ideas behind the many recent works that apply the gradient flow to the determination of the renormalized coupling and the renormalization of composite operators. We will pay special attention to the continuum extrapolation of flow quantities.

  4. Hilbert space renormalization for the many-electron problem

    CERN Document Server

    Li, Zhendong

    2015-01-01

    Renormalization is a powerful concept in the many-body problem. Inspired by the highly successful density matrix renormalization group (DMRG) algorithm, and the quantum chemical graphical representation of configuration space, we introduce a new theoretical tool: Hilbert space renormalization, to describe many-electron correlations. While in DMRG, the many-body states in nested Fock subspaces are successively renormalized, in Hilbert space renormalization, many-body states in nested Hilbert subspaces undergo renormalization. This provides a new way to classify and combine configurations. The underlying wavefunction ansatz, namely the Hilbert space matrix product state (HS-MPS), has a very rich and flexible mathematical structure. It provides low-rank tensor approximations to any configuration interaction (CI) space through restricting either the 'physical indices' or the coupling rules in the HS-MPS. Alternatively, simply truncating the 'virtual dimension' of the HS-MPS leads to a family of size-extensive wav...

  5. 1,2-Difluoroethane: the angular dependance on 1J(CF) coupling constants is independent of hyperconjugation.

    Science.gov (United States)

    Freitas, Matheus P; Bühl, Michael; O'Hagan, David

    2012-02-28

    1,2-Difluoroethane is widely recognised to adopt a lower energy gauche rather than anti conformation; this gauche effect has its origin in hyperconjugation; however, surprisingly the (1)J(CF) coupling constant is not influenced by hyperconjugation; instead, its magnitude changes with the overall molecular dipole.

  6. Importance of triples contributions to NMR spin-spin coupling constants computed at the CC3 and CCSDT levels

    DEFF Research Database (Denmark)

    Faber, Rasmus; Sauer, Stephan P. A.; Gauss, Jürgen

    2017-01-01

    We present the first analytical implementation of CC3 second derivatives using the spin-unrestricted approach. This allows, for the first time, the calculation of nuclear spin-spin coupling constants (SSCC) relevant to NMR spectroscopy at the CC3 level of theory in a fully analytical manner. CC3 ...

  7. Quadrupole coupling constants and isomeric Moessbauer shifts for halogen-containing gold, platinum, niobium, tantalum and antimony compounds

    Energy Technology Data Exchange (ETDEWEB)

    Poleshchuk, O. K., E-mail: poleshch@tspu.edu.ru [Tomsk State Pedagogical University (Russian Federation); Branchadell, V. [Universitat Autonoma de Barcelona, Departament de Quimica (Spain); Ritter, R. A.; Fateev, A. V. [Tomsk State Pedagogical University (Russian Federation)

    2008-01-15

    We have analyzed by means of Density functional theory calculations the nuclear quadrupole coupling constants of a range of gold, antimony, platinum, niobium and tantalum compounds. The geometrical parameters and halogen nuclear quadrupole coupling constants obtained by these calculations substantially corresponded to the data of microwave and nuclear quadrupole resonance spectroscopy. An analysis of the quality of the calculations that employ pseudo-potentials and all-electron basis sets for the halogen compounds was carried out. The zero order regular approximation (ZORA) method is shown to be a viable alternative for the calculation of halogen coupling constants in molecules. In addition, the ZORA model, in contrast to the pseudo-potential model, leads to realistic values of all metal nuclear quadrupole coupling constants. From Klopman's approach, it follows that the relationship between the electrostatic bonding and covalent depends on the nature of the central atom. The results on Moessbauer chemical shifts are also in a good agreement with the coordination number of the central atom.

  8. Determination of the chiral coupling constants c(3) and c(4) in new pp and np partial-wave analyses

    NARCIS (Netherlands)

    Rentmeester, MCM; Timmermans, RGE; de Swart, JJ

    2003-01-01

    As a first result of two new partial-wave analyses, one of the pp and another one of the np scattering data below 500 MeV, we report a study of the long-range chiral two-pion exchange interaction which contains the chiral coupling constants c(1), c(3), and c(4). By using as input a theoretical value

  9. Static Potential in the SU(2)-Higgs Model and Coupling Constant Definitions in Lattice and Continuum Models

    CERN Document Server

    Csikor, Ferenc; Hegedüs, P; Piróth, A

    1999-01-01

    We present a one-loop calculation of the static potential in the SU(2)-Higgs model. The connection to the coupling constant definition used in lattice simulations is clarified. The consequences in comparing lattice simulations and perturbative results for finite temperature applications are explored.

  10. Importance of Triples Contributions to NMR Spin-Spin Coupling Constants Computed at the CC3 and CCSDT Levels.

    Science.gov (United States)

    Faber, Rasmus; Sauer, Stephan P A; Gauss, Jürgen

    2017-02-14

    We present the first analytical implementation of CC3 second derivatives using the spin-unrestricted approach. This allows, for the first time, the calculation of nuclear spin-spin coupling constants (SSCC) relevant to NMR spectroscopy at the CC3 level of theory in a fully analytical manner. CC3 results for the SSCCs of a number of small molecules and their fluorine substituted derivatives are compared with the corresponding coupled cluster singles and doubles (CCSD) results obtained using specialized basis sets. For one-bond couplings the change when going from CCSD to CC3 is typically 1-3%, but much higher corrections were found for (1)JCN in FCN, 15.7%, and (1)JOF in OF2, 6.4%. The changes vary significantly in the case of multibond couplings, with differences of up to 10%, and even 13.6% for (3)JFH in fluoroacetylene. Calculations at the coupled cluster singles, doubles, and triples (CCSDT) level indicate that the most important contributions arising from connected triple excitations in the coupled cluster expansion are accounted for at the CC3 level. Thus, we believe that the CC3 method will become the standard approach for the calculation of reference values of nuclear spin-spin coupling constants.

  11. Density functional theory study of indirect nuclear spin-spin coupling constants with spin-orbit corrections

    Science.gov (United States)

    Oprea, Corneliu I.; Rinkevicius, Zilvinas; Vahtras, Olav; Ågren, Hans; Ruud, Kenneth

    2005-07-01

    This work outlines the calculation of indirect nuclear spin-spin coupling constants with spin-orbit corrections using density functional response theory. The nonrelativistic indirect nuclear spin-spin couplings are evaluated using the linear response method, whereas the relativistic spin-orbit corrections are computed using quadratic response theory. The formalism is applied to the homologous systems H2X (X=O,S,Se,Te) and XH4 (X =C,Si,Ge,Sn,Pb) to calculate the indirect nuclear spin-spin coupling constants between the protons. The results confirm that spin-orbit corrections are important for compounds of the H2X series, for which the electronic structure allows for an efficient coupling between the nuclei mediated by the spin-orbit interaction, whereas in the case of the XH4 series the opposite situation is encountered and the spin-orbit corrections are negligible for all compounds of this series. In addition we analyze the performance of the density functional theory in the calculations of nonrelativistic indirect nuclear spin-spin coupling constants.

  12. Improved Lattice Renormalization Group Techniques

    CERN Document Server

    Petropoulos, Gregory; Hasenfratz, Anna; Schaich, David

    2013-01-01

    We compute the bare step-scaling function $s_b$ for SU(3) lattice gauge theory with $N_f = 12$ massless fundamental fermions, using the non-perturbative Wilson-flow-optimized Monte Carlo Renormalization Group two-lattice matching technique. We use a short Wilson flow to approach the renormalized trajectory before beginning RG blocking steps. By optimizing the length of the Wilson flow, we are able to determine an $s_b$ corresponding to a unique discrete $\\beta$ function, after a few blocking steps. We carry out this study using new ensembles of 12-flavor gauge configurations generated with exactly massless fermions, using volumes up to $32^4$. The results are consistent with the existence of an infrared fixed point (IRFP) for all investigated lattice volumes and number of blocking steps. We also compare different renormalization schemes, each of which indicates an IRFP at a slightly different value of the bare coupling, as expected for an IR-conformal theory.

  13. Investigation of the NMR spin-spin coupling constants across the hydrogen bonds in ubiquitin: the nature of the hydrogen bond as reflected by the coupling mechanism.

    Science.gov (United States)

    Tuttle, Tell; Kraka, Elfi; Wu, Anan; Cremer, Dieter

    2004-04-28

    The indirect scalar NMR spin-spin coupling constants across the H-bonds of the protein ubiquitin were calculated, including the Fermi contact, the diamagnetic spin-orbit, the paramagnetic spin-orbit, and the spin dipole term, employing coupled perturbed density functional theory in combination with the B3LYP functional and different basis sets: (9s,5p,1d/5s,1p)[6s,4p,1d/3s,1p] and (11s,7p,2d/5s,1p)[7s,6p,2d/4s,2p]. Four different models based on either the crystal or the aqueous solution structure of ubiquitin were used to describe H-bonding for selected residue pairs of ubiquitin. Calculated and measured 3hJ(NC') coupling constants differ depending on the model used, which is due to the fact that the geometry of ubiquitin is different in the solid state and in aqueous solution. Also, conformational averaging leads to a decrease of the magnitude of the measured 3hJ(NC') constants, which varies locally (larger for -sheets, smaller for -helix). Two different spin-spin coupling mechanisms were identified. While mechanism I transmits spin polarization via an electric field effect, mechanism II involves also electron delocalization from the lone pair of the carbonyl oxygen to the antibonding orbital of the N-H bond. Mechanism I is more important in the crystal structure of ubiquitin, while in aqueous solution, mechanism II plays a larger role. It is possible to set up simple relationships between the spin-spin coupling constants associated with the H bond in proteins and the geometrical features of these bonds. The importance of the 3hJ(NC') and 1J(N-H) constants as descriptors for the H-bond is emphasized.

  14. The renormalization; La normalisation

    Energy Technology Data Exchange (ETDEWEB)

    Rivasseau, V. [Paris-6 Univ., Lab. de Physique Theorique, 91 - Orsay (France); Gallavotti, G. [Universita di Roma, La Sapienza, Fisica, Roma (Italy); Zinn-Justin, J. [CEA Saclay, Dept. d' Astrophysique, de Physique des Particules, de Physique Nucleaire et de l' Instrumentation Associee, Serv. de Physique Theorique, 91- Gif sur Yvette (France); Connes, A. [College de France, 75 - Paris (France)]|[Institut des Hautes Etudes Scientifiques - I.H.E.S., 91 - Bures sur Yvette (France); Knecht, M. [Centre de Physique Theorique, CNRS-Luminy, 13 - Marseille (France); Mansoulie, B. [CEA Saclay, Dept. d' Astrophysique, de Physique des Particules, de Physique Nucleaire et de l' Instrumentation Associee, Serv. de Physique des Particules, 91- Gif sur Yvette (France)

    2002-07-01

    This document gathers 6 articles. In the first article the author reviews the theory of perturbative renormalization, discusses its limitations and gives a brief introduction to the powerful point of view of the renormalization group, which is necessary to go beyond perturbation theory and to define renormalization in a constructive way. The second article is dedicated to renormalization group methods by illustrating them with examples. The third article describes the implementation of renormalization ideas in quantum field theory. The mathematical aspects of renormalization are given in the fourth article where the link between renormalization and the Riemann-Hilbert problem is highlighted. The fifth article gives an overview of the main features of the theoretical calculations that have been done in order to obtain accurate predictions for the anomalous magnetic moments of the electron and of the muon within the standard model. The challenge is to make theory match the unprecedented accuracy of the last experimental measurements. The last article presents how ''physics beyond the standard model'' will be revealed at the large hadron collider (LHC) at CERN. This accelerator will be the first to explore the 1 TeV energy range directly. Supersymmetry, extra-dimensions and Higgs boson will be the different challenges. It is not surprising that all theories put forward today to subtend the electro-weak breaking mechanism, predict measurable or even spectacular signals at LHC. (A.C.)

  15. On the discrepancy between theory and experiment for the F-F spin-spin coupling constant of difluoroethyne.

    Science.gov (United States)

    Faber, Rasmus; Sauer, Stephan P A

    2012-12-21

    The vicinal indirect nuclear spin-spin coupling constant (SSCC) between the two fluorine atoms in difluoroethyne has been reinvestigated. This coupling has previously proved to be difficult to calculate accurately. In this study we have therefore systematically investigated the dependence of this coupling on the choice of one-electron basis set, the choice of correlated wave function method and the inclusion of zero-point vibrational and temperature corrections. All terms of the SSCC have been evaluated at the second-order polarization propagator, SOPPA and SOPPA(CCSD), and coupled cluster singles and doubles (CCSD) levels of theory and for the most correlation dependent term, the paramagnetic spin-orbit contribution (PSO), also at the very accurate CC3 level. We find that in order to get results that are well converged with respect to the basis set, one needs to use special SSCC optimized basis sets of at least quadruple zeta quality and with added diffuse functions. Furthermore, the PSO term is not yet converged at the CCSD level as shown by the CC3 calculations. Finally, it is shown that vibrational effects are very important, as they are in this case of the same order of magnitude as the equilibrium geometry value of the coupling constant. Only by using a converged basis set and including both vibrational and higher order correlation effects can we obtain agreement with the experimental value for this coupling.

  16. Non-perturbative renormalization of the energy-momentum tensor in SU(3) Yang-Mills theory

    CERN Document Server

    Giusti, Leonardo

    2014-01-01

    We present a strategy for a non-perturbative determination of the finite renormalization constants of the energy-momentum tensor in the SU(3) Yang-Mills theory. The computation is performed by imposing on the lattice suitable Ward Identites at finite temperature in presence of shifted boundary conditions. We show accurate preliminary numerical data for values of the bare coupling g_0^2 ranging for 0 to 1.

  17. Electric field effects on one-bond indirect spin-spin coupling constants and possible biomolecular perspectives.

    Science.gov (United States)

    Sahakyan, Aleksandr B; Shahkhatuni, Aleksan G; Shahkhatuni, Astghik A; Panosyan, Henry A

    2008-04-24

    Electric field (EF) induced changes of one-bond indirect spin-spin coupling constants are investigated on a wide range of molecules including peptide models. EFs were both externally applied and internally calculated without external EF application by the hybrid density functional theory method. Reliable agreement with experimental data has been obtained for calculated one-bond J-couplings. The role of the EF sign and direction, internal and induced components, hydrogen bonding, internuclear distance and hyperconjugative interactions on the one-bond J-coupling vs EF interconnection is analyzed. A linear dependence of 1J on EF projection along the bond is obtained, if the bound atoms possess different enough electron densities and an EF determined by the electronic polarization exists along the bond. Accentuating the 1JNH couplings as possible EF sensitive parameters, a systematic study is done in two sets of molecules with a large variation of the native internal EF value. The most EF affected component of the 1JNH coupling constant is the spin-dipole term of Ramsey's formulation; however, in the total J-coupling formation, the EF influence on the Fermi contact term is the most significant. The induced EF projection along the bond is 6.7 times weaker in magnitude than the simulated external uniform field. The absolute EF dependence of the one-bond J-coupling involves only the internal field, which is the sum of the induced field (if the external field exists) and the internuclear field determined by the native polarization. That linear and universal dependence joins the corresponding couplings in a diverse set of molecules under various electrostatic conditions. Many types of the one-bond J-couplings can be potentially measured in biomolecules, and the study of their relation with the electrostatic properties at the corresponding sites opens a new avenue to the full exploitation of the NMR measurable parameters with novel and exciting applications.

  18. Non-Perturbative Renormalization

    CERN Document Server

    Mastropietro, Vieri

    2008-01-01

    The notion of renormalization is at the core of several spectacular achievements of contemporary physics, and in the last years powerful techniques have been developed allowing to put renormalization on a firm mathematical basis. This book provides a self-consistent and accessible introduction to the sophisticated tools used in the modern theory of non-perturbative renormalization, allowing an unified and rigorous treatment of Quantum Field Theory, Statistical Physics and Condensed Matter models. In particular the first part of this book is devoted to Constructive Quantum Field Theory, providi

  19. Investigations of thickness-shear mode elastic constant and damping of shunted piezoelectric materials with a coupling resonator

    Science.gov (United States)

    Hu, Ji-Ying; Li, Zhao-Hui; Sun, Yang; Li, Qi-Hu

    2016-12-01

    Shear-mode piezoelectric materials have been widely used to shunt the damping of vibrations where utilizing surface or interface shear stresses. The thick-shear mode (TSM) elastic constant and the mechanical loss factor can change correspondingly when piezoelectric materials are shunted to different electrical circuits. This phenomenon makes it possible to control the performance of a shear-mode piezoelectric damping system through designing the shunt circuit. However, due to the difficulties in directly measuring the TSM elastic constant and the mechanical loss factor of piezoelectric materials, the relationships between those parameters and the shunt circuits have rarely been investigated. In this paper, a coupling TSM electro-mechanical resonant system is proposed to indirectly measure the variations of the TSM elastic constant and the mechanical loss factor of piezoelectric materials. The main idea is to transform the variations of the TSM elastic constant and the mechanical loss factor into the changes of the easily observed resonant frequency and electrical quality factor of the coupling electro-mechanical resonator. Based on this model, the formular relationships are set up theoretically with Mason equivalent circuit method and they are validated with finite element (FE) analyses. Finally, a prototype of the coupling electro-mechanical resonator is fabricated with two shear-mode PZT5A plates to investigate the TSM elastic constants and the mechanical loss factors of different circuit-shunted cases of the piezoelectric plate. Both the resonant frequency shifts and the bandwidth changes observed in experiments are in good consistence with the theoretical and FE analyses under the same shunt conditions. The proposed coupling resonator and the obtained relationships are validated with but not limited to PZT5A. Project supported by the National Defense Foundation of China (Grant No. 9149A12050414JW02180).

  20. Random vibrational networks and the renormalization group.

    Science.gov (United States)

    Hastings, M B

    2003-04-11

    We consider the properties of vibrational dynamics on random networks, with random masses and spring constants. The localization properties of the eigenstates contrast greatly with the Laplacian case on these networks. We introduce several real-space renormalization techniques which can be used to describe this dynamics on general networks, drawing on strong disorder techniques developed for regular lattices. The renormalization group is capable of elucidating the localization properties, and provides, even for specific network instances, a fast approximation technique for determining the spectra which compares well with exact results.

  1. Self-Consistency Requirements of the Renormalization Group for Setting the Renormalization Scale

    Energy Technology Data Exchange (ETDEWEB)

    Brodsky, Stanley J. [SLAC National Accelerator Lab., Menlo Park, CA (United States); Wu, Xing-Gang [Chongqing Univ. (China); SLAC National Accelerator Lab., Menlo Park, CA (United States)

    2012-08-07

    In conventional treatments, predictions from fixed-order perturbative QCD calculations cannot be fixed with certainty due to ambiguities in the choice of the renormalization scale as well as the renormalization scheme. In this paper we present a general discussion of the constraints of the renormalization group (RG) invariance on the choice of the renormalization scale. We adopt the RG based equations, which incorporate the scheme parameters, for a general exposition of RG invariance, since they simultaneously express the invariance of physical observables under both the variation of the renormalization scale and the renormalization scheme parameters. We then discuss the self-consistency requirements of the RG, such as reflexivity, symmetry, and transitivity, which must be satisfied by the scale-setting method. The Principle of Minimal Sensitivity (PMS) requires the slope of the approximant of an observable to vanish at the renormalization point. This criterion provides a scheme-independent estimation, but it violates the symmetry and transitivity properties of the RG and does not reproduce the Gell-Mann-Low scale for QED observables. The Principle of Maximum Conformality (PMC) satisfies all of the deductions of the RG invariance - reflectivity, symmetry, and transitivity. Using the PMC, all non-conformal {βRi}-terms (R stands for an arbitrary renormalization scheme) in the perturbative expansion series are summed into the running coupling, and one obtains a unique, scale-fixed, scheme-independent prediction at any finite order. The PMC scales and the resulting finite-order PMC predictions are both to high accuracy independent of the choice of initial renormalization scale, consistent with RG invariance.

  2. Determination of (3)J((1)H3'-(31)P) couplings in a DNA oligomer with enhanced sensitivity employing a constant-time TOCSY difference experiment.

    Science.gov (United States)

    Reith, Lorenz M; Schlagnitweit, Judith; Smrecki, Vilko; Knör, Günther; Müller, Norbert; Schoefberger, Wolfgang

    2011-03-01

    A constant-time TOCSY difference experiment for the determination of (3)J((1)H3'-(31)P) coupling constants in non-isotope-labelled DNA oligonucleotides is presented. The method is tested on a DNA octamer and compared with the established constant-time NOESY difference method. Each (3)J((1)H3'-(31)P) coupling constant is determined from amplitude changes caused by phosphorous decoupling, which are observable on multiple cross-peaks, thus leading to a high accuracy of the value of the (3)J((1)H3'-(31)P) coupling constant. The new experiment delivers up to three times the sensitivity compared with previously reported methods.

  3. Enhancement of field renormalization in scalar theories via functional renormalization group

    CERN Document Server

    Zappalà, Dario

    2012-01-01

    The flow equations of the Functional Renormalization Group are applied to the O(N)-symmetric scalar theory, for N=1 and N=4, to determine the effective potential and the renormalization function of the field in the broken phase. The flow equations of these quantities are derived from a reduction of the full flow of the effective action onto a set of equations for the n-point vertices of the theory. In our numerical analysis, the infrared limit, corresponding to the vanishing of the running momentum scale in the equations, is approached to obtain the physical values of the parameters by extrapolation. In the N=4 theory a non-perturbatively large value of the physical renormalization of the longitudinal component of the field is observed. The dependence of the field renormalization on the UV cut-off and on the bare coupling is also investigated.

  4. Two-loop renormalization in the standard model, part III. Renormalization equations and their solutions

    Energy Technology Data Exchange (ETDEWEB)

    Actis, S. [Deutsches Elektronen-Synchrotron (DESY), Zeuthen (Germany); Passarino, G. [Torino Univ. (Italy). Dipt. di Fisica Teorica; INFN, Sezione di Torino (Italy)

    2006-12-15

    In part I and II of this series of papers all elements have been introduced to extend, to two loops, the set of renormalization procedures which are needed in describing the properties of a spontaneously broken gauge theory. In this paper, the final step is undertaken and finite renormalization is discussed. Two-loop renormalization equations are introduced and their solutions discussed within the context of the minimal standard model of fundamental interactions. These equations relate renormalized Lagrangian parameters (couplings and masses) to some input parameter set containing physical (pseudo-)observables. Complex poles for unstable gauge and Higgs bosons are used and a consistent setup is constructed for extending the predictivity of the theory from the Lep1 Z-boson scale (or the Lep2 WW scale) to regions of interest for LHC and ILC physics. (orig.)

  5. S3 HMBC hetero: Spin-State-Selective HMBC for accurate measurement of long-range heteronuclear coupling constants

    DEFF Research Database (Denmark)

    Hoeck, Casper; Gotfredsen, Charlotte Held; Sørensen, Ole W.

    2017-01-01

    A novel method, Spin-State-Selective (S3) HMBC hetero, for accurate measurement of heteronuclear coupling constants is introduced. The method extends the S3 HMBC technique for measurement of homonuclear coupling constants by appending a pulse sequence element that interchanges the polarization in...... of techniques, the accuracy of coupling constant measurement is independent of the size of the coupling constant of interest. The merits of the new method are demonstrated by application to vinyl acetate, the alkaloid strychnine, and the carbohydrate methyl β-maltoside....

  6. Stereochemical dependence of 3JCH coupling constants in 2-substituted 4-t-butyl-cyclohexanone and their alcohol derivatives.

    Science.gov (United States)

    Favaro, Denize C; Ducati, Lucas C; dos Santos, Francisco P; Contreras, Rubén H; Tormena, Cláudio F

    2011-12-22

    Theoretical and experimental studies on (3)J(C2H6eq) NMR spin-spin coupling constants in both the 2-X-4-t-butyl-cyclohexanone (X = H, CH(3), F, Cl, and Br) and in their alcohol derivatives series are reported. Results thus found are rationalized in terms of the transmission of the Fermi contact contribution to such couplings. To this end, dependencies of (3)J(C2H6eq) couplings versus the C(2)-C(1)-C(6) angle are compared in both series for equatorial and axial X orientations. The main trend is described in terms of the rear lobes interaction. Besides, for X = halogen atom in equatorial orientation a rather strong interaction between oxygen and halogen lone pairs is observed, and its influence on (3)J(C2H6eq) couplings is discussed and rationalized in terms of different Fermi contact transmission pathways.

  7. Mass renormalization and binding energies in quantum field theory

    Science.gov (United States)

    Lv, Q. Z.; Stefanovich, E.; Su, Q.; Grobe, R.

    2017-10-01

    We compare the predictions of two methods of determining the amount of binding energy between two distinguishable fermions that interact with each other through force-intermediating bosons. Both measures try to quantify this binding energy by the downward shift of the fully interacting two-fermion ground state energy relative to the sum of the corresponding two single-particle ground state energies. The first method computes this energy difference directly from the standard quantum field theoretical Hamiltonian. The second method uses the mass renormalized form of this Hamiltonian. In order to have a concrete example for this comparison, we employ a simple Yukawa-like model system in one spatial dimension. We find that both approaches lead to identical predictions in the second and fourth order perturbation of the coupling constant, and they remain remarkably close even in the strong coupling domain where perturbation theory diverges. This illustrates that there are field theoretical systems for which rather accurate binding energies can be obtained even without the mass renormalization procedure.

  8. 13C-detected NMR experiments for measuring chemical shifts and coupling constants in nucleic acid bases.

    Science.gov (United States)

    Fiala, Radovan; Sklenár, Vladimír

    2007-10-01

    The paper presents a set of two-dimensional experiments that utilize direct (13)C detection to provide proton-carbon, carbon-carbon and carbon-nitrogen correlations in the bases of nucleic acids. The set includes a (13)C-detected proton-carbon correlation experiment for the measurement of (13)C-(13)C couplings, the CaCb experiment for correlating two quaternary carbons, the HCaCb experiment for the (13)C-(13)C correlations in cases where one of the carbons has a proton attached, the HCC-TOCSY experiment for correlating a proton with a network of coupled carbons, and a (13)C-detected (13)C-(15)N correlation experiment for detecting the nitrogen nuclei that cannot be detected via protons. The IPAP procedure is used for extracting the carbon-carbon couplings and/or carbon decoupling in the direct dimension, while the S(3)E procedure is preferred in the indirect dimension of the carbon-nitrogen experiment to obtain the value of the coupling constant. The experiments supply accurate values of (13)C and (15)N chemical shifts and carbon-carbon and carbon-nitrogen coupling constants. These values can help to reveal structural features of nucleic acids either directly or via induced changes when the sample is dissolved in oriented media.

  9. Singular Renormalization Group Equations

    OpenAIRE

    Minoru, HIRAYAMA; Department of Physics, Toyama University

    1984-01-01

    The possible behaviour of the effective charge is discussed in Oehme and Zimmermann's scheme of the renormalization group equation. The effective charge in an example considered oscillates so violently in the ultraviolet limit that the bare charge becomes indefinable.

  10. Calculation of hyperfine structure constants of small molecules using Z-vector method in the relativistic coupled-cluster framework

    Indian Academy of Sciences (India)

    SUDIP SASMAL; KAUSHIK TALUKDAR; MALAYA K NAYAK; NAYANA VAVAL; SOURAV PAL

    2016-10-01

    The Z-vector method in the relativistic coupled-cluster framework is employed to calculate the parallel and perpendicular components of the magnetic hyperfine structure constant of a few small alkaline earth hydrides (BeH, MgH, and CaH) and fluorides (MgF and CaF). We have compared our Z-vector results with the values calculated by the extended coupled-cluster (ECC) method reported in Phys. Rev. A 91 022512 (2015). All these results are compared with the available experimental values. The Z-vector results are found to be in better agreement with the experimental values than those of the ECC values.

  11. Renormalization of supersymmetric theories

    Energy Technology Data Exchange (ETDEWEB)

    Pierce, D.M.

    1998-06-01

    The author reviews the renormalization of the electroweak sector of the standard model. The derivation also applies to the minimal supersymmetric standard model. He discusses regularization, and the relation between the threshold corrections and the renormalization group equations. He considers the corrections to many precision observables, including M{sub W} and sin{sup 2}{theta}{sup eff}. He shows that global fits to the data exclude regions of supersymmetric model parameter space and lead to lower bounds on superpartner masses.

  12. Adiabatic Coupling Constant of Nitrobenzene- n-Alkane Critical Mixtures. Evidence from Ultrasonic Spectra and Thermodynamic Data

    Science.gov (United States)

    Mirzaev, Sirojiddin Z.; Kaatze, Udo

    2016-09-01

    Ultrasonic spectra of mixtures of nitrobenzene with n-alkanes, from n-hexane to n-nonane, are analyzed. They feature up to two Debye-type relaxation terms with discrete relaxation times and, near the critical point, an additional relaxation term due to the fluctuations in the local concentration. The latter can be well represented by the dynamic scaling theory. Its amplitude parameter reveals the adiabatic coupling constant of the mixtures of critical composition. The dependence of this thermodynamic parameter upon the length of the n-alkanes corresponds to that of the slope in the pressure dependence of the critical temperature and is thus taken another confirmation of the dynamic scaling model. The change in the variation of the coupling constant and of several other mixture parameters with alkane length probably reflects a structural change in the nitrobenzene- n-alkane mixtures when the number of carbon atoms per alkane exceeds eight.

  13. The effect of inclusion of $\\Delta$ resonances in relativistic mean-field model with scaled hadron masses and coupling constants

    CERN Document Server

    Maslov, K A; Voskresensky, D N

    2016-01-01

    Knowledge of the equation of state of the baryon matter plays a decisive role in the description of neutron stars. With an increase of the baryon density the filling of Fermi seas of hyperons and $\\Delta$ isobars becomes possible. Their inclusion into standard relativistic mean-field models results in a strong softening of the equation of state and a lowering of the maximum neutron star mass below the measured values. We extend a relativistic mean-field model with scaled hadron masses and coupling constants developed in our previous works and take into account now not only hyperons but also the $\\Delta$ isobars. We analyze available empirical information to put constraints on coupling constants of $\\Delta$s to mesonic mean fields. We show that the resulting equation of state satisfies majority of presently known experimental constraints.

  14. Spontaneous mode switching in coupled oscillators competing for constant amounts of resources.

    Science.gov (United States)

    Hirata, Yoshito; Aono, Masashi; Hara, Masahiko; Aihara, Kazuyuki

    2010-03-01

    We propose a widely applicable scheme of coupling that models competitions among dynamical systems for fixed amounts of resources. Two oscillators coupled in this way synchronize in antiphase. Three oscillators coupled circularly show a number of oscillation modes such as rotation and partially in-phase synchronization. Intriguingly, simple oscillators in the model also produce complex behavior such as spontaneous switching among different modes. The dynamics reproduces well the spatiotemporal oscillatory behavior of a true slime mold Physarum, which is capable of computational optimization.

  15. Time-dependent Diffusion Coefficient and Conventional Diffusion Constant of Nanoparticles in Polymer Melts by Mode-coupling Theory

    Institute of Scientific and Technical Information of China (English)

    Xin-yu Lai; Nan-rong Zhao

    2013-01-01

    Time-dependent diffusion coefficient and conventional diffusion constant are calculated and analyzed to study diffusion of nanoparticles in polymer melts.A generalized Langevin equation is adopted to describe the diffusion dynamics.Mode-coupling theory is employed to calculate the memory kernel of friction.For simplicity,only microscopic terms arising from binary collision and coupling to the solvent density fluctuation are included in the formalism.The equilibrium structural information functions of the polymer nanocomposites required by mode-coupling theory are calculated on the basis of polymer reference interaction site model with Percus-Yevick closure.The effect of nanoparticle size and that of the polymer size are clarified explicitly.The structural functions,the friction kernel,as well as the diffusion coefficient show a rich variety with varying nanoparticle radius and polymer chain length.We find that for small nanoparticles or short chain polymers,the characteristic short time non-Markov diffusion dynamics becomes more prominent,and the diffusion coefficient takes longer time to approach asymptotically the conventional diffusion constant.This constant due to the microscopic contributions will decrease with the increase of nanoparticle size,while increase with polymer size.Furthermore,our result of diffusion constant from modecoupling theory is compared with the value predicted from the Stokes-Einstein relation.It shows that the microscopic contributions to the diffusion constant are dominant for small nanoparticles or long chain polymers.Inversely,when nanonparticle is big,or polymer chain is short,the hydrodynamic contribution might play a significant role.

  16. Perturbative renormalization of the electric field correlator

    CERN Document Server

    Christensen, C

    2016-01-01

    The momentum diffusion coefficient of a heavy quark in a hot QCD plasma can be extracted as a transport coefficient related to the correlator of two colour-electric fields dressing a Polyakov loop. We determine the perturbative renormalization factor for a particular lattice discretization of this correlator within Wilson's SU(3) gauge theory, finding a ~12% NLO correction for values of the bare coupling used in the current generation of simulations. The impact of this result on existing lattice determinations is commented upon, and a possibility for non-perturbative renormalization through the gradient flow is pointed out.

  17. Perturbative renormalization of the electric field correlator

    Directory of Open Access Journals (Sweden)

    C. Christensen

    2016-04-01

    Full Text Available The momentum diffusion coefficient of a heavy quark in a hot QCD plasma can be extracted as a transport coefficient related to the correlator of two colour-electric fields dressing a Polyakov loop. We determine the perturbative renormalization factor for a particular lattice discretization of this correlator within Wilson's SU(3 gauge theory, finding a ∼12% NLO correction for values of the bare coupling used in the current generation of simulations. The impact of this result on existing lattice determinations is commented upon, and a possibility for non-perturbative renormalization through the gradient flow is pointed out.

  18. Perturbative renormalization of the electric field correlator

    Science.gov (United States)

    Christensen, C.; Laine, M.

    2016-04-01

    The momentum diffusion coefficient of a heavy quark in a hot QCD plasma can be extracted as a transport coefficient related to the correlator of two colour-electric fields dressing a Polyakov loop. We determine the perturbative renormalization factor for a particular lattice discretization of this correlator within Wilson's SU(3) gauge theory, finding a ∼ 12% NLO correction for values of the bare coupling used in the current generation of simulations. The impact of this result on existing lattice determinations is commented upon, and a possibility for non-perturbative renormalization through the gradient flow is pointed out.

  19. Coupled cluster study of spectroscopic constants of ground states of heavy rare gas dimers with spin-orbit interaction

    Science.gov (United States)

    Tu, Zhe-Yan; Wang, Wen-Liang; Li, Ren-Zhong; Xia, Cai-Juan; Li, Lian-Bi

    2016-07-01

    The CCSD(T) approach based on two-component relativistic effective core potential with spin-orbit interaction just included in coupled cluster iteration is adopted to study the spectroscopic constants of ground states of Kr2, Xe2 and Rn2 dimers. The spectroscopic constants have significant basis set dependence. Extrapolation to the complete basis set limit provides the most accurate values. The spin-orbit interaction hardly affects the spectroscopic constants of Kr2 and Xe2. However, the equilibrium bond length is shortened about 0.013 Å and the dissociation energy is augmented about 18 cm-1 by the spin-orbit interaction for Rn2 in the complete basis set limit.

  20. Renormalization of the QED of second order spin 1/2 fermions

    CERN Document Server

    Angeles-Martinez, Rene

    2011-01-01

    In this work we study the renormalization of the electrodynamics of spin 1/2 fermions in the Poincare projector formalism which is second order in the derivatives of the fields. We analyze the degree of superficial divergence of the vertex functions and calculate 2- and 3-point vertex functions at one-loop level. It is shown that these functions are renormalizable independently of the value of the gyromagnetic factor g which is a free parameter of the theory. We find a photon propagator and a running coupling constant alpha (q^2) that depends on the value of g. In general, the magnetic moment form factor of the one-loop Feynman diagrams contributions to the fermion-fermion-gamma vertex function contains a divergence associated to g. This requires the coupling g to be renormalized. Imposing as the renormalization condition g(q^2=0) to be the measured gyromagnetic factor at low energy we obtain a one loop finite correction Delta{g}=g alpha/2pi. For a particle with g=2 the divergence associated to this coupling ...

  1. Constraining the time variation of the coupling constants from cosmic microwave background: effect of \\Lambda_{QCD}

    CERN Document Server

    Nakashima, Masahiro; Nagata, Ryo; Yokoyama, Jun'ichi

    2009-01-01

    We investigate constraints on the time variation of the fine structure constant between the recombination epoch and the present epoch, $\\Delta\\alpha/\\alpha \\equiv (\\alpha_{rec} - \\alpha_{now})/\\alpha_{now}$, from cosmic microwave background (CMB) taking into account simultaneous variation of other physical constants, namely the electron mass $m_{e}$ and the proton mass $m_{p}$. In other words, we consider the variation of Yukawa coupling and the QCD scale $\\Lambda_{QCD}$ in addition to the electromagnetic coupling. We clarify which parameters can be determined from CMB temperature anisotropy in terms of singular value decomposition. Assuming a relation among variations of coupling constants governed by a single scalar field (the dilaton), the 95 % confidence level (C.L.) constraint on $\\Delta\\alpha/\\alpha$ is found to be $-8.28 \\times 10^{-3} < \\Delta\\alpha/\\alpha < 1.81 \\times 10^{-3}$, which is tighter than the one obtained by considering only the change of $\\alpha$ and $m_{e}$. We also obtain the con...

  2. Renormalization group analysis of turbulence

    Science.gov (United States)

    Smith, Leslie M.

    1989-01-01

    The objective is to understand and extend a recent theory of turbulence based on dynamic renormalization group (RNG) techniques. The application of RNG methods to hydrodynamic turbulence was explored most extensively by Yakhot and Orszag (1986). An eddy viscosity was calculated which was consistent with the Kolmogorov inertial range by systematic elimination of the small scales in the flow. Further, assumed smallness of the nonlinear terms in the redefined equations for the large scales results in predictions for important flow constants such as the Kolmogorov constant. It is emphasized that no adjustable parameters are needed. The parameterization of the small scales in a self-consistent manner has important implications for sub-grid modeling.

  3. Position-space renormalization-group investigation of the spin-3/2 Blume-Emery-Griffiths model with repulsive biquadratic coupling

    Science.gov (United States)

    Bakchich, A.; El Bouziani, M.

    2001-01-01

    Phase transitions of a four-component lattice gas or spin-3/2 Blume-Emery-Griffiths model, with a single-ion uniaxial anisotropy and nearest-neighbour pair interactions, both bilinear and biquadratic, are investigated for two-dimensional lattices using an approximate renormalization-group approach of the Migdal-Kadanoff type. The set of fixed points and flows provide the characteristic phase diagrams, in the case of repulsive biquadratic interaction, featuring four ordered phases including high-entropy ferrimagnetic and staggered quadrupolar phases. Successive phase transitions and multicritical points are also found.

  4. Quantum Einstein gravity. Advancements of heat kernel-based renormalization group studies

    Energy Technology Data Exchange (ETDEWEB)

    Groh, Kai

    2012-10-15

    The asymptotic safety scenario allows to define a consistent theory of quantized gravity within the framework of quantum field theory. The central conjecture of this scenario is the existence of a non-Gaussian fixed point of the theory's renormalization group flow, that allows to formulate renormalization conditions that render the theory fully predictive. Investigations of this possibility use an exact functional renormalization group equation as a primary non-perturbative tool. This equation implements Wilsonian renormalization group transformations, and is demonstrated to represent a reformulation of the functional integral approach to quantum field theory. As its main result, this thesis develops an algebraic algorithm which allows to systematically construct the renormalization group flow of gauge theories as well as gravity in arbitrary expansion schemes. In particular, it uses off-diagonal heat kernel techniques to efficiently handle the non-minimal differential operators which appear due to gauge symmetries. The central virtue of the algorithm is that no additional simplifications need to be employed, opening the possibility for more systematic investigations of the emergence of non-perturbative phenomena. As a by-product several novel results on the heat kernel expansion of the Laplace operator acting on general gauge bundles are obtained. The constructed algorithm is used to re-derive the renormalization group flow of gravity in the Einstein-Hilbert truncation, showing the manifest background independence of the results. The well-studied Einstein-Hilbert case is further advanced by taking the effect of a running ghost field renormalization on the gravitational coupling constants into account. A detailed numerical analysis reveals a further stabilization of the found non-Gaussian fixed point. Finally, the proposed algorithm is applied to the case of higher derivative gravity including all curvature squared interactions. This establishes an improvement

  5. Spectral editing of weakly coupled spins using variable flip angles in PRESS constant echo time difference spectroscopy: Application to GABA

    Science.gov (United States)

    Snyder, Jeff; Hanstock, Chris C.; Wilman, Alan H.

    2009-10-01

    A general in vivo magnetic resonance spectroscopy editing technique is presented to detect weakly coupled spin systems through subtraction, while preserving singlets through addition, and is applied to the specific brain metabolite γ-aminobutyric acid (GABA) at 4.7 T. The new method uses double spin echo localization (PRESS) and is based on a constant echo time difference spectroscopy approach employing subtraction of two asymmetric echo timings, which is normally only applicable to strongly coupled spin systems. By utilizing flip angle reduction of one of the two refocusing pulses in the PRESS sequence, we demonstrate that this difference method may be extended to weakly coupled systems, thereby providing a very simple yet effective editing process. The difference method is first illustrated analytically using a simple two spin weakly coupled spin system. The technique was then demonstrated for the 3.01 ppm resonance of GABA, which is obscured by the strong singlet peak of creatine in vivo. Full numerical simulations, as well as phantom and in vivo experiments were performed. The difference method used two asymmetric PRESS timings with a constant total echo time of 131 ms and a reduced 120° final pulse, providing 25% GABA yield upon subtraction compared to two short echo standard PRESS experiments. Phantom and in vivo results from human brain demonstrate efficacy of this method in agreement with numerical simulations.

  6. CAL3JHH: a Java program to calculate the vicinal coupling constants (3J H,H) of organic molecules.

    Science.gov (United States)

    Aguirre-Valderrama, Alonso; Dobado, José A

    2008-12-01

    Here, we present a free web-accessible application, developed in the JAVA programming language for the calculation of vicinal coupling constant (3J(H,H)) of organic molecules with the H-Csp3-Csp3-H fragment. This JAVA applet is oriented to assist chemists in structural and conformational analyses, allowing the user to calculate the averaged 3J(H,H) values among conformers, according to its Boltzmann populations. Thus, the CAL3JHH program uses the Haasnoot-Leeuw-Altona equation, and, by reading the molecule geometry from a protein data bank (PDB) file format or from multiple pdb files, automatically detects all the coupled hydrogens, evaluating the data needed for this equation. Moreover, a "Graphical viewer" menu allows the display of the results on the 3D molecule structure, as well as the plotting of the Newman projection for the couplings.

  7. A theoretical investigation of Ferromagnetic Resonance Linewidth and damping constants in coupled trilayer and spin valve systems

    Energy Technology Data Exchange (ETDEWEB)

    Layadi, A. [LESIMS, Departement de Physique, Université Ferhat Abbas, Sétif 19000 (Algeria)

    2015-05-15

    The ferromagnetic resonance intrinsic field linewidth ΔH is investigated for a multilayer system such as a coupled trilayer and a spin valve structure. The magnetic coupling between two ferromagnetic layers separated by a nonmagnetic interlayer will be described by the bilinear J{sub 1} and biquadratic J{sub 2} coupling parameters. The interaction at the interface of the first ferromagnetic layer with the antiferromagnetic one is account for by the exchange anisotropy field, H{sub E}. A general formula is derived for the intrinsic linewidth ΔH. The explicit dependence of ΔH with H{sub E}, J{sub 1} and J{sub 2} will be highlighted. Analytical expressions for each mode field linewidth are found in special cases. Equivalent damping constants will be discussed.

  8. CAL3JHH: a Java program to calculate the vicinal coupling constants (3 J H,H) of organic molecules

    Science.gov (United States)

    Aguirre-Valderrama, Alonso; Dobado, José A.

    2008-12-01

    Here, we present a free web-accessible application, developed in the JAVA programming language for the calculation of vicinal coupling constant (3 J H,H) of organic molecules with the H-Csp3-Csp3-H fragment. This JAVA applet is oriented to assist chemists in structural and conformational analyses, allowing the user to calculate the averaged 3 J H,H values among conformers, according to its Boltzmann populations. Thus, the CAL3JHH program uses the Haasnoot-Leeuw-Altona equation, and, by reading the molecule geometry from a protein data bank (PDB) file format or from multiple pdb files, automatically detects all the coupled hydrogens, evaluating the data needed for this equation. Moreover, a "Graphical viewer" menu allows the display of the results on the 3D molecule structure, as well as the plotting of the Newman projection for the couplings.

  9. Renormalized Wick expansion for a modified PQCD

    CERN Document Server

    de Oca, Alejandro Cabo Montes

    2007-01-01

    The renormalization scheme for the Wick expansion of a modified version of the perturbative QCD introduced in previous works is discussed. Massless QCD is considered, by implementing the usual multiplicative scaling of the gluon and quark wave functions and vertices. However, also massive quark and gluon counter-terms are allowed in this mass less theory since the condensates are expected to generate masses. A natural set of expansion parameters of the physical quantities is introduced: the coupling itself and to masses $m_q$ and $m_g$ associated to quarks and gluons respectively. This procedure allows to implement a dimensional transmutation effect through these new mass scales. A general expression for the new generating functional in terms of the mass parameters $m_q$ and $m_g$ is obtained in terms of integrals over arbitrary but constant gluon or quark fields in each case. Further, the one loop potential, is evaluated in more detail in the case when only the quark condensate is retained. This lowest order...

  10. Renormalized Wick expansion for a modified PQCD

    Energy Technology Data Exchange (ETDEWEB)

    Cabo Montes de Oca, Alejandro [Instituto de Cibernetica, Matematica y Fisica, Group of Theoretical Physics, Vedado, La Habana (Cuba); Abdus Salam International Centre for Theoretical Physics, Trieste (Italy)

    2008-05-15

    The renormalization scheme for the Wick expansion of a modified version of the perturbative QCD introduced in previous works is discussed. Massless QCD is considered by implementing the usual multiplicative scaling of the gluon and quark wave functions and vertices. However, also massive quark and gluon counterterms are allowed in this massless theory since the condensates are expected to generate masses. A natural set of expansion parameters of the physical quantities is introduced: the coupling itself and the two masses m{sub q} and m{sub g} associated to quarks and gluons, respectively. This procedure allows one to implement a dimensional transmutation effect through these new mass scales. A general expression for the new generating functional in terms of the mass parameters m{sub q} and m{sub g} is obtained in terms of integrals over arbitrary but constant gluon or quark fields in each case. Further, the one loop potential is evaluated in more detail in the case when only the quark condensate is retained. This lowest order result again indicates the dynamical generation of quark condensates in the vacuum. (orig.)

  11. Renormalization group flow of scalar models in gravity

    Energy Technology Data Exchange (ETDEWEB)

    Guarnieri, Filippo

    2014-04-08

    In this Ph.D. thesis we study the issue of renormalizability of gravitation in the context of the renormalization group (RG), employing both perturbative and non-perturbative techniques. In particular, we focus on different gravitational models and approximations in which a central role is played by a scalar degree of freedom, since their RG flow is easier to analyze. We restrict our interest in particular to two quantum gravity approaches that have gained a lot of attention recently, namely the asymptotic safety scenario for gravity and the Horava-Lifshitz quantum gravity. In the so-called asymptotic safety conjecture the high energy regime of gravity is controlled by a non-Gaussian fixed point which ensures non-perturbative renormalizability and finiteness of the correlation functions. We then investigate the existence of such a non trivial fixed point using the functional renormalization group, a continuum version of the non-perturbative Wilson's renormalization group. In particular we quantize the sole conformal degree of freedom, which is an approximation that has been shown to lead to a qualitatively correct picture. The question of the existence of a non-Gaussian fixed point in an infinite-dimensional parameter space, that is for a generic f(R) theory, cannot however be studied using such a conformally reduced model. Hence we study it by quantizing a dynamically equivalent scalar-tensor theory, i.e. a generic Brans-Dicke theory with ω=0 in the local potential approximation. Finally, we investigate, using a perturbative RG scheme, the asymptotic freedom of the Horava-Lifshitz gravity, that is an approach based on the emergence of an anisotropy between space and time which lifts the Newton's constant to a marginal coupling and explicitly preserves unitarity. In particular we evaluate the one-loop correction in 2+1 dimensions quantizing only the conformal degree of freedom.

  12. Nuclear Data in Oklo and Time-Variability of Fundamental Coupling Constants

    CERN Document Server

    Fujii, Y; Fukahori, T; Ohnuki, T; Nakagawa, M; Hidaka, H; Oura, Y; Møller, P; Fujii, Yasunori; Iwamoto, Akira; Fukahori, Tokio; Ohnuki, Toshihiko; Nakagawa, Masayuki; Hidaka, Hiroshi; Oura, Yasuji; Moller, Peter

    2001-01-01

    We re-examined Shlyakhter's analysis of the Sm data in Oklo. With a special care of minimizing contamination due to the inflow of the isotope after the end of the reactor activity, we confirmed that his result on the time-variability of the fine-structure constant, $|\\dot{\\alpha}/\\alpha |\\lsim 10^{-17}{\\rm y}^{-1}$, was basically correct. In addition to this upper bound, however, we obtained another result that indicates a different value of $\\alpha$ 2 billion years ago. We add comments on the recent result from QSO's.

  13. Leading hadronic contributions to the running of the electroweak coupling constants from lattice QCD

    Energy Technology Data Exchange (ETDEWEB)

    Burger, Florian [OakLabs GmbH, Hennigsdorf (Germany); Jansen, Karl [Deutsches Elektronen-Synchrotron (DESY), Zeuthen (Germany). John von Neumann-Inst. fuer Computing NIC; Petschlies, Marcus [Bonn Univ. (Germany). Inst. fuer Strahlen- und Kernphysik; Pientka, Grit [Humboldt-Universitaet, Berlin (Germany). Inst. fuer Physik

    2015-12-15

    The quark-connected leading-order hadronic contributions to the running of the electromagnetic fine structure constant, α{sub QED}, and the weak mixing angle, θ{sub W}, are determined by a four-flavour lattice QCD computation with twisted mass fermions. Full agreement of the results with a phenomenological analysis is observed with an even comparable statistical uncertainty. We show that the uncertainty of the lattice calculation is dominated by systematic effects which then leads to significantly larger errors than obtained by the phenomenological analysis.

  14. Using J-coupling constants for force field validation: application to hepta-alanine.

    Science.gov (United States)

    Georgoulia, Panagiota S; Glykos, Nicholas M

    2011-12-29

    A computational solution to the protein folding problem is the holy grail of biomolecular simulation and of the corresponding force fields. The complexity of the systems used for folding simulations precludes a direct feedback between the simulations and the force fields, thus necessitating the study of simpler systems with sufficient experimental data to allow force field optimization and validation. Recent studies on short polyalanine peptides of increasing length (up to penta-alanine) indicated the presence of a systematic deviation between the experimental (NMR-derived) J-couplings and the great majority of biomolecular force fields, with the χ(2) values for even the best-performing force fields being in the 1.4-1.8 range. Here we show that by increasing the number of residues to seven and by achieving convergence through an increase of the simulation time to 2 μs, we can identify one force field (the AMBER99SB force field, out of the three force fields studied) which when compared with the experimental J-coupling data (and for a specific set of Karplus equation parameters and estimated J-coupling errors previously used in the literature) gave a value of χ(2) = 0.99, indicating that full statistical consistency between experiment and simulation is feasible. However, and as a detailed analysis of the effects of estimated errors shows, the χ(2) values may be unsuitable as indicators of the goodness of fit of the various biomolecular force fields. © 2011 American Chemical Society

  15. Exact renormalization of the photino mass in softly broken ${\\cal N}=1$ SQED with $N_f$ flavors regularized by higher derivatives

    CERN Document Server

    Nartsev, I V

    2016-01-01

    We consider the softly broken ${\\cal N}=1$ supersymmetric electrodynamics, regularized by higher derivatives. For this theory we demonstrate that the renormalization of the photino mass is determined by integrals of double total derivatives in the momentum space in all orders. Consequently, it is possible to derive the NSVZ-like exact relation between the photino mass anomalous dimension and the anomalous dimension of the matter superfields in the rigid theory by direct summation of supergraphs. It is important that both these renormalization group functions are defined in terms of the bare coupling constant, so that the considered NSVZ-like relation is valid independently of the subtraction scheme in the case of using the higher derivative regularization. The factorization of integrals defining the photino mass renormalization into integrals of double total derivatives is verified by an explicit two-loop calculation.

  16. On the Renormalization of Heavy Quark Effective Field Theory

    CERN Document Server

    Kilian, W

    1994-01-01

    The construction of heavy quark effective field theory (HqEFT) is extended to arbitrary order in both expansion parameters $\\alpha_s$ and $1/m_q$. Matching conditions are discussed for the general case, and it is verified that this approach correctly reproduces the infrared behaviour of full QCD. Choosing a renormalization scheme in the full theory fixes the renormalization scheme in the effective theory except for the scale of the heavy quark field. Explicit formulae are given for the effective Lagrangian, and one--loop matching renormalization constants are computed for the operators of order $1/m$. Finally, the multiparticle sector of HqEFT is considered.

  17. GIAO-DFT isotropic magnetic shielding constants and spin-spin coupling of tartaric acid in water solution

    Science.gov (United States)

    Fideles, Bruna; Oliveira, Leonardo B. A.; Colherinhas, Guilherme

    2016-01-01

    We investigate the nuclear isotropic shielding constants and spin-spin coupling for oxygen and carbons atoms of isomers of tartaric acid in gas phase and in water solutions by Monte Carlo simulation and quantum mechanics calculations using the GIAO-B3LYP approach. Solute polarization effects are included iteratively and play an important role in the quantitative determination of shielding constants. Our MP2/aug-cc-pVTZ results show substantial increases of the dipole moment in solution as compared with the gas phase results (61-221%). The solvent effects on the σ(13O) values are in general small. More appreciable solvent effects can be seen on the σ(17O) and J(Csbnd O).

  18. GIAO-DFT Isotropic magnetic shielding constants and spin-spin coupling of tartaric acid in water solution

    CERN Document Server

    Fideles, Bruna; Colherinhas, Guilherme

    2015-01-01

    We investigate the nuclear isotropic shielding constants and spin-spin coupling for oxygen and carbons atoms of isomers of tartaric acid in gas phase and water solutions by Monte Carlo simulation and quantum mechanics calculations using the GIAO-B3LYP approach. Solute polarization effects are included iteratively and play an important role in the quantitative determination of shielding constants. Our MP2/aug-cc-pVTZ results show substantial increases of the dipole moment in solution as compared with the gas phase results (61-221%). The solvent effects on the {\\sigma}(13C) [J(C-C)] values are in general small. More appreciable solvent effects can be seen on the {\\sigma}(17O) and J(C-O).

  19. Renormalization Group Equations for the CKM matrix

    CERN Document Server

    Kielanowski, P; Montes de Oca Y, J H

    2008-01-01

    We derive the one loop renormalization group equations for the Cabibbo-Kobayashi-Maskawa matrix for the Standard Model, its two Higgs extension and the minimal supersymmetric extension in a novel way. The derived equations depend only on a subset of the model parameters of the renormalization group equations for the quark Yukawa couplings so the CKM matrix evolution cannot fully test the renormalization group evolution of the quark Yukawa couplings. From the derived equations we obtain the invariant of the renormalization group evolution for three models which is the angle $\\alpha$ of the unitarity triangle. For the special case of the Standard Model and its extensions with $v_{1}\\approx v_{2}$ we demonstrate that also the shape of the unitarity triangle and the Buras-Wolfenstein parameters $\\bar{\\rho}=(1-{1/2}\\lambda^{2})\\rho$ and $\\bar{\\eta}=(1-{1/2}\\lambda^{2})\\eta$ are conserved. The invariance of the angles of the unitarity triangle means that it is not possible to find a model in which the CKM matrix mi...

  20. Spin Sum Rules and the Strong Coupling Constant at large distance.

    Energy Technology Data Exchange (ETDEWEB)

    Alexandre Deur

    2009-07-01

    We present recent results on the Bjorken and the generalized forward spin polarizability sum rules from Jefferson Lab Hall A and CLAS experiments, focusing on the low $Q^2$ part of the measurements. We then discuss the comparison of these results with Chiral Perturbation theory calculations. In the second part of this paper, we show how the Bjorken sum rule with its connection to the Gerasimov-Drell-Hearn sum, allows us to conveniently define an effective coupling for the strong force at all distances.

  1. Determination of the Axial-Vector Weak Coupling Constant with Polarized Ultracold Neutrons

    CERN Document Server

    Liu, J; Holley, A T; Back, H O; Bowles, T J; Broussard, L J; Carr, R; Clayton, S; Currie, S; Filippone, B W; Garcia, A; Geltenbort, P; Hickerson, K P; Hoagland, J; Hogan, G E; Hona, B; Ito, T M; Liu, C -Y; Makela, M; Mammei, R R; Martin, J W; Melconian, D; Morris, C L; Pattie, R W; Galvan, A Perez; Pitt, M L; Plaster, B; Ramsey, J C; Rios, R; Russell, R; Saunders, A; Seestrom, S; Sondheim, W E; Tatar, E; Vogelaar, R B; VornDick, B; Wrede, C; Yan, H; Young, A R

    2010-01-01

    A precise measurement of the neutron decay $\\beta$-asymmetry $A_0$ has been carried out using polarized ultracold neutrons (UCN) from the pulsed spallation UCN source at the Los Alamos Neutron Science Center (LANSCE). Combining data obtained in 2008 and 2009, we report $A_0 = -0.11966 \\pm 0.00089 _{-0.00140}^{+0.00123}$, from which we determine the ratio of the axial-vector to vector weak coupling of the nucleon $g_A/g_V = -1.27590 _{-0.00445}^{+0.00409}$.

  2. Renormalization of the energy-momentum tensor on the lattice

    CERN Document Server

    Pepe, Michele

    2015-01-01

    We present the calculation of the non-perturbative renormalization constants of the energy-momentum tensor in the SU(3) Yang-Mills theory. That computation is carried out in the framework of shifted boundary conditions, where a thermal quantum field theory is formulated in a moving reference frame. The non-perturbative renormalization factors are then used to measure the Equation of State of the SU(3) Yang-Mills theory. Preliminary numerical results are presented and discussed.

  3. Improved constraints on the coupling constants of axion-like particles to nucleons from recent Casimir-less experiment

    Energy Technology Data Exchange (ETDEWEB)

    Klimchitskaya, G.L.; Mostepanenko, V.M. [Central Astronomical Observatory at Pulkovo of the Russian Academy of Sciences, St. Petersburg (Russian Federation); St. Petersburg State Polytechnical University, Institute of Physics, Nanotechnology and Telecommunications, St. Petersburg (Russian Federation)

    2015-04-01

    We obtain improved constraints on the coupling constants of axion-like particles to nucleons from a recently performed Casimir-less experiment. For this purpose, the differential force between a Au-coated sphere and either the Au or the Si sector of a rotating disc, arising due to two-axion exchange, is calculated. Over a wide region of axion masses, from 1.7 x 10{sup -3} eV to 0.9 eV, the obtained constraints are up to a factor of 60 stronger than the previously known ones following from the Cavendish-type experiment and measurements of the effective Casimir pressure. (orig.)

  4. Strong-coupling constant with flavor thresholds at five loops in the anti M anti S scheme

    Energy Technology Data Exchange (ETDEWEB)

    Kniehl, B.A.; Kotikov, A.V.; Onishchenko, A.I.; Veretin, O.L. [Hamburg Univ. (Germany). 2. Inst. fuer Theoretische Physik

    2006-07-15

    We present in analytic form the matching conditions for the strong-coupling constant {alpha}{sub s}{sup (n{sub f})}({mu}) at the flavor thresholds to four loops in the modified minimal-subtraction scheme. Taking into account the present knowledge on the coefficient {beta}{sub 4} of the Callan-Symanzik beta function of quantum chromo-dynamics, we thus derive a five-loop formula for {alpha}{sub s}{sup (n{sub f})}({mu}) together with appropriate relationships between the asymptotic scale parameters {lambda}{sup (n{sub f})} for different numbers of flavors n{sub f}. (Orig.)

  5. A determination of the strong coupling constant α s from W production at the CERN pp¯ collider

    Science.gov (United States)

    Alitti, J.; Ambrosini, G.; Ansari, R.; Autiero, D.; Bareyre, P.; Bertram, I. A.; Blaylock, G.; Bonamy, P.; Bonesini, M.; Borer, K.; Bourliaud, M.; Buskulic, D.; Carboni, G.; Cavalli, D.; Cavasinni, V.; Cenci, P.; Chollet, J. C.; Conta, C.; Costa, G.; Costantini, F.; Cozzi, L.; Cravero, A.; Curatolo, M.; Dell'Acqua, A.; DelPrete, T.; DeWolf, R. S.; DiLella, L.; Ducros, Y.; Egan, G. F.; Einsweiler, K. F.; Esposito, B.; Fayard, L.; Federspiel, A.; Ferrari, R.; Fraternali, M.; Froidevaux, D.; Fumagalli, G.; Gaillard, J. M.; Gianotti, F.; Gildemeister, O.; Gössling, C.; Goggi, V. G.; Grünendahl, S.; Hara, K.; Hellman, S.; Hrivnac, J.; Hufnagel, H.; Hugentobler, E.; Hultqvist, K.; Iacopini, E.; Incandela, J.; Jakobs, K.; Jenni, P.; Kluge, E. E.; Kurz, N.; Lami, S.; Lariccia, P.; Lefebvre, M.; Linssen, L.; Livan, M.; Lubrano, P.; Magneville, C.; Mandelli, L.; Mapelli, L.; Mazzanti, M.; Meier, B.; Merkel, B.; Meyer, J. P.; Moniez, M.; Moning, R.; Morganti, M.; Müller, L.; Munday, D. J.; Nessi, M.; Nessi-Tedaldi, F.; Onions, C.; Pal, T.; Parker, M. A.; Parrour, G.; Pastore, F.; Pennacchio, E.; Pentney, J. M.; Pepe, M.; Perini, L.; Petridou, C.; Petroff, P.; Plothow-Besch, H.; Polesello, G.; Poppleton, A.; Pretzl, K.; Primavera, M.; Punturo, M.; Repellin, J. P.; Rimoldi, A.; Sacchi, M.; Scampoli, P.; Schacher, J.; Simak, V.; Singh, S. L.; Sondermann, V.; Stapnes, S.; Stirling, A. V.; Talamonti, C.; Tondini, F.; Tovey, S. N.; Tsesmelis, E.; Unal, G.; Valdata-Nappi, M.; Vercesi, V.; Weidberg, A. R.; Wells, P. S.; White, T. O.; Wood, D. R.; Wotton, S. A.; Zaccone, H.; Zylberstejn, A.; UA2 Collaboration

    1991-07-01

    The large sample of W→eν events collected by the UA2 experiment at the CERN pp¯ collider between 1988 and 1990 has been used to determine the strong coupling constant α s. From a measurement of the ratio of the production rate of W events with one jet to that with no jets, α s has been extracted to second order in the MS¯ scheme: α s(M {2}/{w})=0.123±0.0.18( stat.)±0.017 ( syst.) .

  6. Evaluation of the strong coupling constant {alpha}{sub s} using the ATLAS inclusive jet cross-section data

    Energy Technology Data Exchange (ETDEWEB)

    Malaescu, B. [European Organization for Nuclear Research (CERN), Geneva (Switzerland); Starovoitov, P. [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany)

    2012-03-15

    We perform a determination of the strong coupling constant using the latest ATLAS inclusive jet cross section data, from proton-proton collisions at {radical}(s)=7 TeV, and their full information on the bin-to-bin correlations. Several procedures for combining the statistical information from the different data inputs are studied and compared. The theoretical prediction is obtained using NLO QCD, and it also includes non-perturbative corrections. Our determination uses inputs with transverse momenta between 45 and 600 GeV, the running of the strong coupling being also tested in this range. Good agreement is observed when comparing our result with the world average at the Z-boson scale, as well as with the most recent results from the Tevatron. (orig.)

  7. Cosmological Solutions of Tensor–Vector Theories of Gravity by Varying the Space-Time–Matter Coupling Constant

    Indian Academy of Sciences (India)

    A. Izadi; A. Shojai; M. Nouradini

    2013-03-01

    We consider tensor–vector theories by varying the space-time–matter coupling constant (varying Einstein velocity) in a spatially flat FRW universe.We examine the dynamics of this model by dynamical system method assuming a CDM background and we find some exact solutions by considering the character of critical points of the theory and their stability conditions. Then we reconstruct the potential (2) and the coupling (2) by demanding a background CDM cosmology. Also we set restrictions on the varying Einstein velocity to solve the horizon problem. This gives a selection rule for choosing the appropriate stable solution. We will see that it is possible to produce the background expansion history () indicated by observations. Finally we will discuss the behavior of the speed of light (E) for those solutions.

  8. Investigation of renormalization effects in high temperature cuprate superconductors

    Energy Technology Data Exchange (ETDEWEB)

    Zabolotnyy, Volodymyr B.

    2008-04-16

    It has been found that the self-energy of high-T{sub C} cuprates indeed exhibits a well pronounced structure, which is currently attributed to coupling of the electrons either to lattice vibrations or to collective magnetic excitations in the system. To clarify this issue, the renormalization effects and the electronic structure of two cuprate families Bi{sub 2}Sr{sub 2}CaCu{sub 2}O{sub 8+{delta}} and YBa{sub 2}Cu{sub 3}O{sub 7-{delta}} were chosen as the main subject for this thesis. With a simple example of an electronic system coupled to a collective mode unusual renormalization features observed in the photoemission spectra are introduced. It is shown that impurity substitution in general leads to suppression of the unusual renormalization. Finally an alternative possibility to obtain a purely superconducting surface of Y-123 via partial substitution of Y atoms with Ca is introduced. It is shown that renormalization in the superconducting Y-123 has similar strong momentum dependence as in the Bi-2212 family. It is also shown that in analogy to Bi-2212 the renormalization appears to have strong dependence on the doping level (no kinks for the overdoped component) and practically vanishes above T{sub C} suggesting that coupling to magnetic excitations fits much better than competing scenarios, according to which the unusual renormalization in ARPES spectra is caused by the coupling to single or multiple phononic modes. (orig.)

  9. Basis invariant measure of CP-violation and renormalization

    Directory of Open Access Journals (Sweden)

    A. Hohenegger

    2015-10-01

    Full Text Available We analyze, in the context of a simple toy model, for which renormalization schemes the CP-properties of bare Lagrangian and its finite part coincide. We show that this is the case for the minimal subtraction and on-shell schemes. The CP-properties of the theory can then be characterized by CP-odd basis invariants expressed in terms of renormalized masses and couplings. For the minimal subtraction scheme we furthermore show that in CP-conserving theories the CP-odd basis invariants are zero at any scale but are not renormalization group invariant in CP-violating ones.

  10. Measurements of the Strong Coupling Constant and the QCD Colour Factors using Four-jet Observables from Hadronic Z Decays

    CERN Document Server

    Heister, A; Barate, R; De Bonis, I; Décamp, D; Goy, C; Lees, J P; Merle, E; Minard, M N; Pietrzyk, B; Boix, G; Bravo, S; Casado, M P; Chmeissani, M; Crespo, J M; Fernández, E; Fernández-Bosman, M; Garrido, L; Graugès-Pous, E; Martínez, M; Merino, G; Miquel, R; Mir, L M; Pacheco, A; Ruiz, H; Colaleo, A; Creanza, D; De Palma, M; Iaselli, Giuseppe; Maggi, G; Maggi, M; Nuzzo, S; Ranieri, A; Raso, G; Ruggieri, F; Selvaggi, G; Silvestris, L; Tempesta, P; Tricomi, A; Zito, G; Huang, X; Lin, J; Ouyang, Q; Wang, T; Xie, Y; Xu, R; Xue, S; Zhang, J; Zhang, L; Zhao, W; Abbaneo, D; Azzurri, P; Buchmüller, O L; Cattaneo, M; Cerutti, F; Clerbaux, B; Drevermann, H; Forty, R W; Frank, M; Gianotti, F; Greening, T C; Hansen, J B; Harvey, J; Hutchcroft, D E; Janot, P; Jost, B; Kado, M; Mato, P; Moutoussi, A; Ranjard, F; Rolandi, Luigi; Schlatter, W D; Schneider, O; Sguazzoni, G; Tejessy, W; Teubert, F; Valassi, Andrea; Videau, I; Ward, J; Badaud, F; Falvard, A; Gay, P; Henrard, P; Jousset, J; Michel, B; Monteil, S; Montret, J C; Pallin, D; Perret, P; Hansen, J D; Hansen, J R; Hansen, P H; Nilsson, B S; Kyriakis, A; Markou, C; Simopoulou, Errietta; Vayaki, Anna; Zachariadou, K; Blondel, A; Bonneaud, G R; Brient, J C; Rougé, A; Rumpf, M; Swynghedauw, M; Verderi, M; Videau, H L; Ciulli, V; Focardi, E; Parrini, G; Antonelli, A; Antonelli, M; Bencivenni, G; Bossi, F; Campana, P; Capon, G; Chiarella, V; Laurelli, P; Mannocchi, G; Murtas, F; Murtas, G P; Passalacqua, L; Pepé-Altarelli, M; Halley, A; Lynch, J G; Negus, P; O'Shea, V; Raine, C; Thompson, A S; Wasserbaech, S R; Cavanaugh, R J; Dhamotharan, S; Geweniger, C; Hanke, P; Hepp, V; Kluge, E E; Putzer, A; Stenzel, H; Tittel, K; Wunsch, M; Beuselinck, R; Binnie, David M; Cameron, W; Dornan, P J; Girone, M; Marinelli, N; Sedgbeer, J K; Thompson, J C; Ghete, V M; Girtler, P; Kneringer, E; Kuhn, D; Rudolph, G; Bouhova-Thacker, E; Bowdery, C K; Finch, A J; Foster, F; Hughes, G; Jones, R W L; Pearson, M R; Robertson, N A; Jakobs, K; Kleinknecht, K; Quast, G; Renk, B; Sander, H G; Wachsmuth, H W; Zeitnitz, C; Bonissent, A; Coyle, P; Leroy, O; Payre, P; Rousseau, D; Talby, M; Ragusa, F; David, A; Dietl, H; Ganis, G; Hüttmann, K; Lütjens, G; Männer, W; Moser, H G; Settles, Ronald; Wiedenmann, W; Wolf, G; Boucrot, J; Callot, O; Davier, M; Duflot, L; Grivaz, J F; Heusse, P; Jacholkowska, A; Lefrançois, J; Veillet, J J; Yuan, C; Bagliesi, G; Boccali, T; Foà, L; Giammanco, A; Giassi, A; Ligabue, F; Messineo, A; Palla, Fabrizio; Sanguinetti, G; Sciabà, A; Spagnolo, P; Tenchini, Roberto; Venturi, A; Verdini, P G; Xie, Z; Blair, G A; Cowan, G; Green, M G; Medcalf, T; Misiejuk, A; Strong, J A; Teixeira-Dias, P; Clifft, R W; Edgecock, T R; Norton, P R; Tomalin, I R; Bloch-Devaux, B; Colas, P; Emery, S; Kozanecki, Witold; Lançon, E; Lemaire, M C; Locci, E; Pérez, P; Rander, J; Renardy, J F; Roussarie, A; Schuller, J P; Schwindling, J; Trabelsi, A; Vallage, B; Konstantinidis, N P; Litke, A M; Taylor, G; Booth, C N; Cartwright, S L; Combley, F; Lehto, M H; Thompson, L F; Affholderbach, K; Böhrer, A; Brandt, S; Grupen, Claus; Ngac, A; Prange, G; Sieler, U; Giannini, G; Rothberg, J E; Armstrong, S R; Berkelman, K; Cranmer, K; Ferguson, D P S; Gao, Y; González, S; Hayes, O J; Hu, H; Jin, S; Kile, J; McNamara, P A; Nielsen, J; Pan, Y B; Von Wimmersperg-Töller, J H; Wu, J; Wu Sau Lan; Wu, X; Zobernig, G

    2003-01-01

    Data from e+e- annihilation into hadrons, taken with the ALEPH detector at the Z resonance, are analyzed. The four-jet rate is studied as a function of the resolution parameter and compared to next-to-leading order calculations combined with resummation of large logarithms. Angular correlations in four-jet events are measured and compared to next-to-leading order QCD predictions. With these observables two different measurements are performed. In a first analysis the strong coupling constant is measured from the four-jet rate yielding alpha_s(M_ Z}) = 0.1170 \\pm 0.0001(stat) \\pm 0.0014(sys) In a second measurement the strong coupling constant and the \\textsc{QCD} colour factors are determined simultaneously from a fit to the four-jet rate and the four-jet angular correlations, giving alpha_s(M_ Z) = 0.119 \\pm 0.006(stat) \\pm 0.026 (sys) C_A = 2.93 \\pm 0.14(stat) \\pm 0.58 (sys) C_F} = 1.35 \\pm 0.07 (stat) \\pm 0.26 (sys) in good agreement with the expectation from QCD.

  11. Non-steady state mass action dynamics without rate constants: dynamics of coupled reactions using chemical potentials

    Science.gov (United States)

    Cannon, William R.; Baker, Scott E.

    2017-10-01

    Comprehensive and predictive simulation of coupled reaction networks has long been a goal of biology and other fields. Currently, metabolic network models that utilize enzyme mass action kinetics have predictive power but are limited in scope and application by the fact that the determination of enzyme rate constants is laborious and low throughput. We present a statistical thermodynamic formulation of the law of mass action for coupled reactions at both steady states and non-stationary states. The formulation uses chemical potentials instead of rate constants. When used to model deterministic systems, the method corresponds to a rescaling of the time dependent reactions in such a way that steady states can be reached on the same time scale but with significantly fewer computational steps. The relationships between reaction affinities, free energy changes and generalized detailed balance are central to the discussion. The significance for applications in systems biology are discussed as is the concept and assumption of maximum entropy production rate as a biological principle that links thermodynamics to natural selection.

  12. Measurement of microscopic coupling constants between atoms on a surface: Combination of LEEM observation with lattice model analysis

    Science.gov (United States)

    Akutsu, Noriko

    2014-12-01

    We present a method combining low-energy electron microscopy (LEEM) and lattice model analysis for measuring the microscopic lateral coupling constants between atoms on a surface. The calculated step (interface) stiffness in a honeycomb lattice Ising model with the nearest neighbor and the second nearest neighbor interactions (J1 = 93.8 meV and J2 = 9.38 meV) matched the experimental step quantity values on an Si(111)(1 × 1) surface reported by Pang et al. and Bartelt et al. based on LEEM measurements. The experimental value of step tension obtained by Williams et al. lies on the calculated step tension curve. The polar graphs of the step tension and a two-dimensional island shape at the temperature T = 1163 K also agree well with the experimental graphs reported by Métois and Müller. The close agreement between the LEEM observations and the lattice model calculations on a Si(111) surface suggests that our method is also suitable for measuring microscopic lateral coupling constants on the surface of other materials that are less well-studied than Si.

  13. Asymptotically AdS_3 Solutions to Topologically Massive Gravity at Special Values of the Coupling Constants

    CERN Document Server

    Garbarz, Alan; Vásquez, Yerko

    2008-01-01

    We study exact solutions to Cosmological Topologically Massive Gravity (CTMG) coupled to Topologically Massive Electrodynamics (TME) at special values of the coupling constants. For the particular case of the so called chiral point l\\mu_G=1, vacuum solutions (with vanishing gauge field) are exhibited. These correspond to a one-parameter deformation of GR solutions, and are continuously connected to the extremal Banados-Teitelboim-Zanelli black hole (BTZ) with bare constants J=-lM. In CTMG this extremal BTZ turns out to be massless, and thus it can be regarded as a kind of ground state. For certain range of parameters, our solution exhibits an event horizon located at finite geodesic distance. Although the solution is not asymptotically AdS_3 in the sense of Brown-Henneaux boundary conditions, it does obey the weakened asymptotic recently proposed by Grumiller and Johansson. Consequently, we discuss the computation of the conserved chages in terms of the stress-tensor in the boundary, and we find that the sign...

  14. Elastic constants measurement of anisotropic Olivier wood plates using air-coupled transducers generated Lamb wave and ultrasonic bulk wave.

    Science.gov (United States)

    Dahmen, Souhail; Ketata, Hassiba; Ben Ghozlen, Mohamed Hédi; Hosten, Bernard

    2010-04-01

    A hybrid elastic wave method is applied to determine the anisotropic constants of Olive wood specimen considered as an orthotropic solid. The method is based on the measurements of the Lamb wave velocities as well as the bulk ultrasonic wave velocities. Electrostatic, air-coupled, ultrasonic transducers are used to generate and receive Lamb waves which are sensitive to material properties. The variation of phase velocity with frequency is measured for several modes propagating parallel and normal to the fiber direction along a thin Olivier wood plates. A numerical model based mainly on an optimization method is developed; it permits to recover seven out of nine elastic constants with an uncertainty of about 15%. The remaining two elastic constants are then obtained from bulk wave measurements. The experimental Lamb phase velocities are in good agreement with the calculated dispersion curves. The evaluation of Olive wood elastic properties has been performed in the low frequency range where the Lamb length wave is large in comparison with the heterogeneity extent. Within the interval errors, the obtained elastic tensor doesn't reveal a large deviation from a uniaxial symmetry.

  15. Dynamical mass generation in QED with magnetic fields: arbitrary field strength and coupling constant

    CERN Document Server

    Rojas, Eduardo; Bashir, Adnan; Raya, Alfredo

    2008-01-01

    We study the dynamical generation of masses for fundamental fermions in quenched quantum electrodynamics, in the presence of magnetic fields of arbitrary strength, by solving the Schwinger-Dyson equation (SDE) for the fermion self-energy in the rainbow approximation. We employ the Ritus eigenfunction formalism which provides a neat solution to the technical problem of summing over all Landau levels. It is well known that magnetic fields catalyze the generation of fermion mass m for arbitrarily small values of electromagnetic coupling \\alpha. For intense fields it is also well known that m \\propto \\sqrt eB. Our approach allows us to span all regimes of parameters \\alpha and eB. We find that m \\propto \\sqrt eB provided \\alpha is small. However, when \\alpha increases beyond the critical value \\alpha_c which marks the onslaught of dynamical fermion masses in vacuum, we find m \\propto \\Lambda, the cut-off required to regularize the ultraviolet divergences. Our method permits us to verify the results available in l...

  16. S3 HMBC: Spin-State-Selective HMBC for accurate measurement of homonuclear coupling constants. Application to strychnine yielding thirteen hitherto unreported JHH

    Science.gov (United States)

    Kjaerulff, Louise; Benie, Andrew J.; Hoeck, Casper; Gotfredsen, Charlotte H.; Sørensen, Ole W.

    2016-02-01

    A novel method, Spin-State-Selective (S3) HMBC, for accurate measurement of homonuclear coupling constants is introduced. As characteristic for S3 techniques, S3 HMBC yields independent subspectra corresponding to particular passive spin states and thus allows determination of coupling constants between detected spins and homonuclear coupling partners along with relative signs. In the presented S3 HMBC experiment, spin-state selection occurs via large one-bond coupling constants ensuring high editing accuracy and unequivocal sign determination of the homonuclear long-range relative to the associated one-bond coupling constant. The sensitivity of the new experiment is comparable to that of regular edited HMBC and the accuracy of the J/RDC measurement is as usual for E.COSY and S3-type experiments independent of the size of the homonuclear coupling constant of interest. The merits of the method are demonstrated by an application to strychnine where thirteen JHH coupling constants not previously reported could be measured.

  17. Screening of heterogeneous surfaces: charge renormalization of Janus particles.

    Science.gov (United States)

    Boon, N; Carvajal Gallardo, E; Zheng, S; Eggen, E; Dijkstra, M; van Roij, R

    2010-03-17

    Nonlinear ionic screening theory for heterogeneously charged spheres is developed in terms of a mode decomposition of the surface charge. A far-field analysis of the resulting electrostatic potential leads to a natural generalization of charge renormalization from purely monopolar to dipolar, quadrupolar, etc, including 'mode couplings'. Our novel scheme is generally applicable to large classes of surface heterogeneities, and is explicitly applied here to Janus spheres with differently charged upper and lower hemispheres, revealing strong renormalization effects for all multipoles.

  18. The local renormalization of super-Yang-Mills theories

    CERN Document Server

    Gillioz, Marc

    2016-01-01

    We show how to consistently renormalize $\\mathcal{N} = 1$ and $\\mathcal{N} = 2$ super-Yang-Mills theories in flat space with a local (i.e. space-time-dependent) renormalization scale in a holomorphic scheme. The action gets enhanced by a term proportional to derivatives of the holomorphic coupling. In the $\\mathcal{N} = 2$ case, this new action is exact at all orders in perturbation theory.

  19. Model system-bath Hamiltonian and nonadiabatic rate constants for proton-coupled electron transfer at electrode-solution interfaces.

    Science.gov (United States)

    Navrotskaya, Irina; Soudackov, Alexander V; Hammes-Schiffer, Sharon

    2008-06-28

    An extension of the Anderson-Newns-Schmickler model for electrochemical proton-coupled electron transfer (PCET) is presented. This model describes reactions in which electron transfer between a solute complex in solution and an electrode is coupled to proton transfer within the solute complex. The model Hamiltonian is derived in a basis of electron-proton vibronic states defined within a double adiabatic approximation for the electrons, transferring proton, and bath modes. The interaction term responsible for electronic transitions between the solute complex and the electrode depends on the proton donor-acceptor vibrational mode within the solute complex. This model Hamiltonian is used to derive the anodic and cathodic rate constants for nonadiabatic electrochemical PCET. The derivation is based on the master equations for the reduced density matrix of the electron-proton subsystem, which includes the electrons of the solute complex and the electrode, as well as the transferring proton. The rate constant expressions differ from analogous expressions for electrochemical electron transfer because of the summation over electron-proton vibronic states and the dependence of the couplings on the proton donor-acceptor vibrational motion. These differences lead to additional contributions to the total reorganization energy, an additional exponential temperature-dependent prefactor, and a temperature-dependent term in the effective activation energy that has different signs for the anodic and cathodic processes. This model can be generalized to describe both nonadiabatic and adiabatic electrochemical PCET reactions and provides the framework for the inclusion of additional effects, such as the breaking and forming of other chemical bonds.

  20. Heisenberg coupling constant predicted for molecular magnets with pairwise spin-contamination correction

    Energy Technology Data Exchange (ETDEWEB)

    Masunov, Artëm E., E-mail: amasunov@ucf.edu [NanoScience Technology Center, Department of Chemistry, and Department of Physics, University of Central Florida, Orlando, FL 32826 (United States); Photochemistry Center RAS, ul. Novatorov 7a, Moscow 119421 (Russian Federation); Gangopadhyay, Shruba [Department of Physics, University of California, Davis, CA 95616 (United States); IBM Almaden Research Center, 650 Harry Road, San Jose, CA 95120 (United States)

    2015-12-15

    New method to eliminate the spin-contamination in broken symmetry density functional theory (BS DFT) calculations is introduced. Unlike conventional spin-purification correction, this method is based on canonical Natural Orbitals (NO) for each high/low spin coupled electron pair. We derive an expression to extract the energy of the pure singlet state given in terms of energy of BS DFT solution, the occupation number of the bonding NO, and the energy of the higher spin state built on these bonding and antibonding NOs (not self-consistent Kohn–Sham orbitals of the high spin state). Compared to the other spin-contamination correction schemes, spin-correction is applied to each correlated electron pair individually. We investigate two binuclear Mn(IV) molecular magnets using this pairwise correction. While one of the molecules is described by magnetic orbitals strongly localized on the metal centers, and spin gap is accurately predicted by Noodleman and Yamaguchi schemes, for the other one the gap is predicted poorly by these schemes due to strong delocalization of the magnetic orbitals onto the ligands. We show our new correction to yield more accurate results in both cases. - Highlights: • Magnetic orbitails obtained for high and low spin states are not related. • Spin-purification correction becomes inaccurate for delocalized magnetic orbitals. • We use the natural orbitals of the broken symmetry state to build high spin state. • This new correction is made separately for each electron pair. • Our spin-purification correction is more accurate for delocalised magnetic orbitals.

  1. Residual dipolar coupling constants and structure determination of large DNA duplexes

    Energy Technology Data Exchange (ETDEWEB)

    Mauffret, Olivier; Tevanian, Georges; Fermandjian, Serge [Institut Gustave-Roussy, Departement de Biologie et Pharmacologie Structurales (France)], E-mail: sfermand@igr.fr

    2002-12-15

    Several NMR works have shown that long-range information provided by residual dipolar couplings (RDCs) significantly improve the global structure definition of RNAs and DNAs. Most of these are based on the use of a large set of RDCs, the collect of which requires samples labeled with {sup 13}C, {sup 15}N, and sometimes, {sup 2}H. Here, we carried out torsion-angle dynamics simulations on a non-self complementary DNA fragment of 17 base-pairs, d(GGAAAATATCTAGCAGT).(ACTGCTAGAGATTTTCC). This reproduces the U5 LTR distal end of the HIV-1 cDNA that contains the enzyme integrase binding site. Simulations aimed at evaluating the impact of RDCs on the structure definition of long oligonucleotides, were performed in incorporating (i) nOe-distances at both < 4.5 A and < 5 A; (ii) a small set of {sup 13}C-{sup 1}H RDCs, easily detectable at the natural abundance, and (iii) a larger set of RDCs only accessible through the {sup 13}C labeling of DNAs. Agreement between a target structure and a simulated structure was measured in terms of precision and accuracy. Results allowed to define conditions in which accurate DNA structures can be determined. We confirmed the strong impact of RDCs on the structure determination, and, above all, we found that a small set of RDC constraints (ca. 50) detectable at the natural abundance is sufficient to accurately derive the global and local DNA duplex structures when used in conjunction with nOe-distances < 5 A.

  2. Correlated calculations of indirect nuclear spin-spin coupling constants using second-order polarization propagator approximations: SOPPA and SOPPA(CCSD)

    DEFF Research Database (Denmark)

    Enevoldsen, Thomas; Oddershede, Jens; Sauer, Stephan P. A.

    1998-01-01

    We present correlated calculations of the indirect nuclear spin-spin coupling constants of HD, HF, H2O, CH4, C2H2, BH, AlH, CO and N2 at the level of the second-order polarization propagator approximation (SOPPA) and the second-order polarization propagator approximation with coupled......-spin coupling constants, were used instead of the in general rather small basis sets used in previous studies. We find that for nearly all couplings the SOPPA(CCSD) method performs better than SOPPA....

  3. Renormalization of multiple infinities and the renormalization group in string loops

    Science.gov (United States)

    Russo, J.; Tseytlin, A. A.

    1990-08-01

    There is a widespread belief that string loop massles divergences may be absorbed into a renormalization of σ-model couplings (space-time metric and dilaton). The crucial property for this idea to be consistently implemented to arbitrary order in string loops should be the renormalizability of the generating functional for string amplitudes. We make several non-trivial checks of the renormalizability by explicit calculations at genus 1, 2 and 3. The renormalizability becomes non-trivial at the log 2ɛ order. We show that the log 2 ɛ counterterms are universal (e.g. the same counterterms provide finiteness both of two-loop scattering amplitudes and of the three-loop partition function) and are related to the log ɛ counterterms (β-functions) in the standard way dictated by the renormalization group. This checks the consistency of the Fischler-Susskind mechanism and implies that the renormalization group acts properly at the string loop level.

  4. Renormalizing the Lippmann-Schwinger equation for the one pion exchange potential

    CERN Document Server

    Eiras, D; Eiras, Dolors; Soto, Joan

    2003-01-01

    We address the question whether the cut-off dependence, which has to be introduced in order to properly define the Lippmann-Schwinger equation for the one pion exchange potential plus local (delta-function) potentials, can be removed (up to inverse powers of it) by a suitable tuning of the various (bare) coupling constants. We prove that this is indeed so both for the spin singlet and for the spin triplet channels. However, the latter requires such a strong cut-off dependence of the coupling constant associated to the non-local term which breaks orbital angular momentum conservation, that the renormalized amplitude lacks from partial wave mixing. We argue that this is an indication that this term must be treated perturbatively.

  5. Analytical continuation in coupling constant method; application to the calculation of resonance energies and widths for organic molecules: Glycine, alanine and valine and dimer of formic acid

    Science.gov (United States)

    Papp, P.; Matejčík, Š.; Mach, P.; Urban, J.; Paidarová, I.; Horáček, J.

    2013-06-01

    The method of analytic continuation in the coupling constant (ACCC) in combination with use of the statistical Padé approximation is applied to the determination of resonance energy and width of some amino acids and formic acid dimer. Standard quantum chemistry codes provide accurate data which can be used for analytic continuation in the coupling constant to obtain the resonance energy and width of organic molecules with a good accuracy. The obtained results are compared with the existing experimental ones.

  6. Renormalization group for non-relativistic fermions.

    Science.gov (United States)

    Shankar, R

    2011-07-13

    A brief introduction is given to the renormalization group for non-relativistic fermions at finite density. It is shown that Landau's theory of the Fermi liquid arises as a fixed point (with the Landau parameters as marginal couplings) and its instabilities as relevant perturbations. Applications to related areas, nuclear matter, quark matter and quantum dots, are briefly discussed. The focus will be on explaining the main ideas to people in related fields, rather than addressing the experts.

  7. One-loop renormalization of fermionic currents with the overlap-Dirac operator

    CERN Document Server

    Alexandrou, C; Panagopoulos, H; Vicari, E

    2000-01-01

    We compute the one-loop lattice renormalization of the two-quark operators$\\bar{\\psi} \\Gamma \\psi$, where $\\Gamma$ denotes the generic Dirac matrix, forthe lattice formulation of QCD using the overlap-Dirac operator. We also study the renormalization of quark bilinears which are more extendedand have better chiral properties. Finally, we present improved estimates of these renormalization constants,coming from cactus resummation and from mean field perturbation theory.

  8. The phase structure of a chirally invariant lattice Higgs-Yukawa model for small and for large values of the Yukawa coupling constant

    CERN Document Server

    Gerhold, P

    2007-01-01

    We consider a chirally invariant lattice Higgs-Yukawa model based on the Neuberger overlap operator. As a first step towards the eventual determination of Higgs mass bounds we study the phase diagram of the model analytically in the large Nf-limit. We present an expression for the effective potential at tree-level in the regime of small Yukawa and quartic coupling constants and determine the order of the phase transitions. In the case of strong Yukawa couplings the model effectively becomes an O(4)-symmetric non-linear sigma-model for all values of the quartic coupling constant. This leads to the existence of a symmetric phase also in the regime of large values of the Yukawa coupling constant. On finite and small lattices, however, strong finite volume effects prevent the expectation value of the Higgs field from vanishing thus obscuring the existence of the symmetric phase at strong Yukawa couplings.

  9. Hilbert space renormalization for the many-electron problem.

    Science.gov (United States)

    Li, Zhendong; Chan, Garnet Kin-Lic

    2016-02-28

    Renormalization is a powerful concept in the many-body problem. Inspired by the highly successful density matrix renormalization group (DMRG) algorithm, and the quantum chemical graphical representation of configuration space, we introduce a new theoretical tool: Hilbert space renormalization, to describe many-electron correlations. While in DMRG, the many-body states in nested Fock subspaces are successively renormalized, in Hilbert space renormalization, many-body states in nested Hilbert subspaces undergo renormalization. This provides a new way to classify and combine configurations. The underlying wavefunction Ansatz, namely, the Hilbert space matrix product state (HS-MPS), has a very rich and flexible mathematical structure. It provides low-rank tensor approximations to any configuration interaction (CI) space through restricting either the "physical indices" or the coupling rules in the HS-MPS. Alternatively, simply truncating the "virtual dimension" of the HS-MPS leads to a family of size-extensive wave function Ansätze that can be used efficiently in variational calculations. We make formal and numerical comparisons between the HS-MPS, the traditional Fock-space MPS used in DMRG, and traditional CI approximations. The analysis and results shed light on fundamental aspects of the efficient representation of many-electron wavefunctions through the renormalization of many-body states.

  10. Compressive Spectral Renormalization Method

    CERN Document Server

    Bayindir, Cihan

    2016-01-01

    In this paper a novel numerical scheme for finding the sparse self-localized states of a nonlinear system of equations with missing spectral data is introduced. As in the Petviashivili's and the spectral renormalization method, the governing equation is transformed into Fourier domain, but the iterations are performed for far fewer number of spectral components (M) than classical versions of the these methods with higher number of spectral components (N). After the converge criteria is achieved for M components, N component signal is reconstructed from M components by using the l1 minimization technique of the compressive sampling. This method can be named as compressive spectral renormalization (CSRM) method. The main advantage of the CSRM is that, it is capable of finding the sparse self-localized states of the evolution equation(s) with many spectral data missing.

  11. Sp(2) Renormalization

    CERN Document Server

    Lavrov, Peter M

    2010-01-01

    The renormalization of general gauge theories on flat and curved space-time backgrounds is considered within the Sp(2)-covariant quantization method. We assume the existence of a gauge-invariant and diffeomorphism invariant regularization. Using the Sp(2)-covariant formalism one can show that the theory possesses gauge invariant and diffeomorphism invariant renormalizability to all orders in the loop expansion and the extended BRST symmetry after renormalization is preserved. The advantage of the Sp(2)-method compared to the standard Batalin-Vilkovisky approach is that, in reducible theories, the structure of ghosts and ghosts for ghosts and auxiliary fields is described in terms of irreducible representations of the Sp(2) group. This makes the presentation of solutions to the master equations in more simple and systematic way because they are Sp(2)- scalars.

  12. Sp(2) renormalization

    Energy Technology Data Exchange (ETDEWEB)

    Lavrov, Peter M., E-mail: lavrov@tspu.edu.r [Department of Mathematical Analysis, Tomsk State Pedagogical University, Kievskaya St. 60, Tomsk 634061 (Russian Federation)

    2011-08-11

    The renormalization of general gauge theories on flat and curved space-time backgrounds is considered within the Sp(2)-covariant quantization method. We assume the existence of a gauge-invariant and diffeomorphism invariant regularization. Using the Sp(2)-covariant formalism one can show that the theory possesses gauge-invariant and diffeomorphism invariant renormalizability to all orders in the loop expansion and the extended BRST-symmetry after renormalization is preserved. The advantage of the Sp(2) method compared to the standard Batalin-Vilkovisky approach is that, in reducible theories, the structure of ghosts and ghosts for ghosts and auxiliary fields is described in terms of irreducible representations of the Sp(2) group. This makes the presentation of solutions to the master equations in more simple and systematic way because they are Sp(2)-scalars.

  13. Renormalizing Entanglement Distillation.

    Science.gov (United States)

    Waeldchen, Stephan; Gertis, Janina; Campbell, Earl T; Eisert, Jens

    2016-01-15

    Entanglement distillation refers to the task of transforming a collection of weakly entangled pairs into fewer highly entangled ones. It is a core ingredient in quantum repeater protocols, which are needed to transmit entanglement over arbitrary distances in order to realize quantum key distribution schemes. Usually, it is assumed that the initial entangled pairs are identically and independently distributed and are uncorrelated with each other, an assumption that might not be reasonable at all in any entanglement generation process involving memory channels. Here, we introduce a framework that captures entanglement distillation in the presence of natural correlations arising from memory channels. Conceptually, we bring together ideas from condensed-matter physics-ideas from renormalization and matrix-product states and operators-with those of local entanglement manipulation, Markov chain mixing, and quantum error correction. We identify meaningful parameter regions for which we prove convergence to maximally entangled states, arising as the fixed points of a matrix-product operator renormalization flow.

  14. Calculations of hyperfine coupling constant of copper(II) in aqueous environment. Finite temperature molecular dynamics and relativistic effects.

    Science.gov (United States)

    Malček, Michal; Bučinský, Lukáš; Valko, Marián; Biskupič, Stanislav

    2015-09-01

    The presented paper is focused on the calculation of hyperfine coupling constants (HFCC) of Cu (2+) ion in water environment. To simulate the conditions of the electron paramagnetic resonance (EPR) experiment in aqueous phase, molecular dynamics using the density functional theory (DFT) was employed. In total three different functionals (BLYP, B3LYP, M06) were employed for studying their suitability in describing coordination of Cu (2+) by water molecules. The system of our interest was composed of one Cu (2+) cation surrounded by a selected number (between thirty and fifty) of water molecules. Besides the non-relativistic HFCCs (Fermi contact terms) of Cu (2+) also the four-component relativistic HFCC calculations are presented. The importance of the proper evaluation of HFCCs, the inclusion of spin-orbit term, for Cu (2+) containing systems (Neese, J. Chem. Phys. 118, 3939 2003; Almeida et al., Chem. Phys. 332, 176 2007) is confirmed at the relativistic four-component level of theory.

  15. Analytic solutions of Oldroyd-B fluid with fractional derivatives in a circular duct that applies a constant couple

    Directory of Open Access Journals (Sweden)

    M.B. Riaz

    2016-12-01

    Full Text Available The aim of this article was to analyze the rotational flow of an Oldroyd-B fluid with fractional derivatives, induced by an infinite circular cylinder that applies a constant couple to the fluid. Such kind of problem in the settings of fractional derivatives has not been found in the literature. The solutions are based on an important remark regarding the governing equation for the non-trivial shear stress. The solutions that have been obtained satisfy all imposed initial and boundary conditions and can easily be reduced to the similar solutions corresponding to ordinary Oldroyd-B, fractional/ordinary Maxwell, fractional/ordinary second-grade, and Newtonian fluids performing the same motion. The obtained results are expressed in terms of Newtonian and non-Newtonian contributions. Finally, the influence of fractional parameters on the velocity, shear stress and a comparison between generalized and ordinary fluids is graphically underlined.

  16. Relativistic mean field theory with density dependent coupling constants for nuclear matter and finite nuclei with large charge asymmetry

    Energy Technology Data Exchange (ETDEWEB)

    Typel, S.; Wolter, H.H. [Sektion Physik, Univ. Muenchen, Garching (Germany)

    1998-06-01

    Nuclear matter and ground state properties for (proton and neutron) semi-closed shell nuclei are described in relativistic mean field theory with coupling constants which depend on the vector density. The parametrization of the density dependence for {sigma}-, {omega}- and {rho}-mesons is obtained by fitting to properties of nuclear matter and some finite nuclei. The equation of state for symmetric and asymmetric nuclear matter is discussed. Finite nuclei are described in Hartree approximation, including a charge and an improved center-of-mass correction. Pairing is considered in the BCS approximation. Special attention is directed to the predictions for properties at the neutron and proton driplines, e.g. for separation energies, spin-orbit splittings and density distributions. (orig.)

  17. Renormalizing Partial Differential Equations

    OpenAIRE

    Bricmont, J.; Kupiainen, A.

    1994-01-01

    In this review paper, we explain how to apply Renormalization Group ideas to the analysis of the long-time asymptotics of solutions of partial differential equations. We illustrate the method on several examples of nonlinear parabolic equations. We discuss many applications, including the stability of profiles and fronts in the Ginzburg-Landau equation, anomalous scaling laws in reaction-diffusion equations, and the shape of a solution near a blow-up point.

  18. The Renormalization Group Limit Cycle for the 1/r^2 Potential

    CERN Document Server

    Braaten, E; Braaten, Eric; Phillips, Demian

    2004-01-01

    Previous work has shown that if an attractive 1/r^2 potential is regularized at short distances by a spherical square-well potential, renormalization allows multiple solutions for the depth of the square well. The depth can be chosen to be a continuous function of the short-distance cutoff R, but it can also be a log-periodic function of R with finite discontinuities, corresponding to a renormalization group (RG) limit cycle. We consider the regularization with a delta-shell potential. In this case, the coupling constant is uniquely determined to be a log-periodic function of R with infinite discontinuities, and an RG limit cycle is unavoidable. In general, a regularization with an RG limit cycle is selected as the correct renormalization of the 1/r^2 potential by the conditions that the cutoff radius R can be made arbitrarily small and that physical observables are reproduced accurately at all energies much less than hbar^2/mR^2.

  19. Holographic renormalization and supersymmetry

    Science.gov (United States)

    Genolini, Pietro Benetti; Cassani, Davide; Martelli, Dario; Sparks, James

    2017-02-01

    Holographic renormalization is a systematic procedure for regulating divergences in observables in asymptotically locally AdS spacetimes. For dual boundary field theories which are supersymmetric it is natural to ask whether this defines a supersymmetric renormalization scheme. Recent results in localization have brought this question into sharp focus: rigid supersymmetry on a curved boundary requires specific geometric structures, and general arguments imply that BPS observables, such as the partition function, are invariant under certain deformations of these structures. One can then ask if the dual holographic observables are similarly invariant. We study this question in minimal N = 2 gauged supergravity in four and five dimensions. In four dimensions we show that holographic renormalization precisely reproduces the expected field theory results. In five dimensions we find that no choice of standard holographic counterterms is compatible with supersymmetry, which leads us to introduce novel finite boundary terms. For a class of solutions satisfying certain topological assumptions we provide some independent tests of these new boundary terms, in particular showing that they reproduce the expected VEVs of conserved charges.

  20. Renormalization group: New relations between the parameters of the Standard Model

    Science.gov (United States)

    Juárez W., S. Rebeca; Kielanowski, Piotr; Mora, Gerardo; Bohm, Arno

    2017-09-01

    We analyze the renormalization group equations for the Standard Model at the one and two loops levels. At one loop level we find an exact constant of evolution built from the product of the quark masses and the gauge couplings g1 and g3 of the U (1) and SU (3) groups. For leptons at one loop level we find that the ratio of the charged lepton mass and the power of g1 varies ≃ 4 ×10-5 in the whole energy range. At the two loop level we have found two relations between the quark masses and the gauge couplings that vary ≃ 4% and ≃ 1%, respectively. For leptons at the two loop level we have derived a relation between the charged lepton mass and the gauge couplings g1 and g2 that varies ≃ 0.1%. This analysis significantly simplifies the picture of the renormalization group evolution of the Standard Model and establishes new important relations between its parameters. There is also included a discussion of the gauge invariance of our relations and its possible relation to the reduction of couplings method.

  1. Renormalization group: New relations between the parameters of the Standard Model

    Directory of Open Access Journals (Sweden)

    S. Rebeca Juárez W.

    2017-09-01

    Full Text Available We analyze the renormalization group equations for the Standard Model at the one and two loops levels. At one loop level we find an exact constant of evolution built from the product of the quark masses and the gauge couplings g1 and g3 of the U(1 and SU(3 groups. For leptons at one loop level we find that the ratio of the charged lepton mass and the power of g1 varies ≃4×10−5 in the whole energy range. At the two loop level we have found two relations between the quark masses and the gauge couplings that vary ≃4% and ≃1%, respectively. For leptons at the two loop level we have derived a relation between the charged lepton mass and the gauge couplings g1 and g2 that varies ≃0.1%. This analysis significantly simplifies the picture of the renormalization group evolution of the Standard Model and establishes new important relations between its parameters. There is also included a discussion of the gauge invariance of our relations and its possible relation to the reduction of couplings method.

  2. The performance of hybrid density functional theory for the calculation of indirect nuclear spin-spin coupling constants in substituted hydrocarbons.

    Science.gov (United States)

    Lutnaes, Ola B; Ruden, Torgeir A; Helgaker, Trygve

    2004-10-01

    Density functional theory, in particular, with the Becke-3-parameter-Lee-Yang-Parr (B3LYP) hybrid functional, has been shown to be a promising method for the calculation of indirect nuclear spin-spin coupling constants. However, no systematic investigation has so far been undertaken to evaluate the capability of B3LYP to calculate these coupling constants accurately, taking properly into account the vibrational contributions. In this work, vibrationally corrected indirect spin-spin coupling constants were calculated using the B3LYP functional for 10 rigid unsubstituted and substituted hydrocarbons: ethyne, ethene, allene, cyclopropene, cyclopropane, cyclobutene, pyrrole, furan, thiophene and benzene. The resulting spin-spin constants were compared with the available experimental values. The basis sets in these calculations give indirect nuclear spin-spin coupling constants of ethyne that are almost converged to the basis-set limit, making the intrinsic error of the computational method and the error in equilibrium geometry the main sources of error. On average, the B3LYP functional overestimates the indirect nuclear spin-spin coupling constants in hydrocarbons by 10%.

  3. Nonlinear Reynolds stress models and the renormalization group

    Science.gov (United States)

    Rubinstein, Robert; Barton, J. Michael

    1990-01-01

    The renormalization group is applied to derive a nonlinear algebraic Reynolds stress model of anisotropic turbulence in which the Reynolds stresses are quadratic functions of the mean velocity gradients. The model results from a perturbation expansion that is truncated systematically at second order with subsequent terms contributing no further information. The resulting turbulence model applied to both low and high Reynolds number flows without requiring wall functions or ad hoc modifications of the equations. All constants are derived from the renormalization group procedure; no adjustable constants arise. The model permits inequality of the Reynolds normal stresses, a necessary condition for calculating turbulence-driven secondary flows in noncircular ducts.

  4. Non-perturbative renormalization group calculation of the quasi-particle velocity and the dielectric function of graphene

    Science.gov (United States)

    Sharma, Anand; Bauer, Carsten; Rueckriegel, Andreas; Kopietz, Peter

    We use a nonperturbative functional renormalization group approach to calculate the renormalized quasiparticle velocity v (k) and the static dielectric function ɛ (k) of suspended graphene as function of an external momentum k. We fit our numerical result for v (k) to v (k) /vF = A + Bln (Λ0 / k) , where vF is the bare Fermi velocity, Λ0 is an ultraviolet cutoff, and A = 1 . 37 , B = 0 . 51 for the physically relevant value (e2 /vF = 2 . 2) of the coupling constant. In stark contrast to calculations based on the static random-phase approximation, we find that ɛ (k) approaches unity for k --> 0 . Our result for v (k) agrees very well with a recent measurement by Elias etal. [Nat. Phys. 7, 701 (2011)]. With in the same approximation, we also explore an alternative scheme in order to understand the true nature of the low energy (momentum) behavior in graphene.

  5. From asymptotic freedom toward heavy quarkonia within the renormalization group procedure for effective particles

    CERN Document Server

    Gómez-Rocha, María

    2016-01-01

    The renormalization group procedure for effective particles (RGPEP), developed as a nonperturbative tool for constructing bound states in quantum field theories, is applied to QCD. The approach stems from the similarity renormalization group and introduces the concept of effective particles. It has been shown that the RGPEP passes the test of exhibiting asymptotic freedom. We present the running of the Hamiltonian coupling with the renormalization-group scale and summarize the basic elements needed in the formulation of the bound-state problem.

  6. Two-Loop Renormalization in the Standard Model

    CERN Document Server

    Actis, S

    2006-01-01

    In part I and II of this series of papers all elements have been introduced to extend, to two loops, the set of renormalization procedures which are needed in describing the properties of a spontaneously broken gauge theory. In this paper, the final step is undertaken and finite renormalization is discussed. Two-loop renormalization equations are introduced and their solutions discussed within the context of the minimal standard model of fundamental interactions. These equations relate renormalized Lagrangian parameters (couplings and masses) to some input parameter set containing physical (pseudo-)observables. Complex poles for unstable gauge and Higgs bosons are used and a consistent setup is constructed for extending the predictivity of the theory from the Lep1 Z-boson scale (or the Lep2 WW scale) to regions of interest for LHC and ILC physics.

  7. Magnetic coupling constants of self-assembled Cu(II) [3×3] grids: alternative spin model from theoretical calculations.

    Science.gov (United States)

    Calzado, Carmen J; Ben Amor, Nadia; Maynau, Daniel

    2014-07-14

    This paper reports a theoretical analysis of the electronic structure and magnetic properties of a ferromagnetic Cu(II) [3×3] grid. A two-step strategy, combining calculations on the whole grid and on binuclear fragments, has been employed to evaluate all the magnetic interactions in the grid. The calculations confirm an S = 7/2 ground state, which is in accordance with the magnetisation versus field curve and the thermal dependence of the magnetic moment data. Only the first-neighbour coupling terms present non-negligible amplitudes, all of them in agreement with the structure and arrangement of the Cu 3d magnetic orbitals. The results indicate that the dominant interaction in the system is the antiferromagnetic coupling between the ring and the central Cu sites (J3 = J4 ≈ -31 cm(-1)). In the ring two different interactions can be distinguished, J1 = 4.6 cm(-1) and J2 = -0.1 cm(-1), in contrast to the single J model employed in the magnetic data fit. The calculated J values have been used to determine the energy level distribution of the Heisenberg magnetic states. The effective magnetic moment versus temperature plot resulting from this ab initio energy profile is in good agreement with the experimental curve and the fitting obtained with the simplified spin model, despite the differences between these two spin models. This study underlines the role that the theoretical evaluations of the coupling constants can play on the rationalisation of the magnetic properties of these complex polynuclear systems.

  8. Renormalization Group Flows, Cycles, and c-Theorem Folklore

    Science.gov (United States)

    Curtright, Thomas L.; Jin, Xiang; Zachos, Cosmas K.

    2012-03-01

    Monotonic renormalization group flows of the “c” and “a” functions are often cited as reasons why cyclic or chaotic coupling trajectories cannot occur. It is argued here, based on simple examples, that this is not necessarily true. Simultaneous monotonic and cyclic flows can be compatible if the flow function is multivalued in the couplings.

  9. On Semi-classical Degravitation and the Cosmological Constant Problems

    CERN Document Server

    Patil, Subodh P

    2010-01-01

    In this report, we discuss a candidate mechanism through which one might address the various cosmological constant problems. We first observe that the renormalization of gravitational couplings (induced by integrating out various matter fields) manifests non-local modifications to Einstein's equations as quantum corrected equations of motion. That is, at the loop level, matter sources curvature through a gravitational coupling that is a non-local function of the covariant d'Alembertian. If the functional form of the resulting Newton's `constant' is such that it annihilates very long wavelength sources, but reduces to $1/M^2_{pl}$ ($M_{pl}$ being the 4d Planck mass) for all sources with cosmologically observable wavelengths, we would have a complimentary realization of the degravitation paradigm-- a realization through which its non-linear completion and the corresponding modified Bianchi identities are readily understood. We proceed to consider various theories whose coupling to gravity may a priori induce no...

  10. Renormalization conditions and non-diagrammatic approach to renormalizations

    OpenAIRE

    Faizullaev, B. A.; Garnov, S. A.

    1996-01-01

    The representation of the bare parameters of Lagrangian in terms of total vertex Green's functions is used to obtain the general form of renormalization conditions. In the framework of this approach renormalizations can be carried out without treatment to Feynman diagrams.

  11. Localized molecular orbital analysis of the effect of electron correlation on the anomalous isotope effect in the NMR spin-spin coupling constant in methane

    DEFF Research Database (Denmark)

    Zarycz, M. Natalia C.; Sauer, Stephan P. A.; Provasi, Patricio F.

    2014-01-01

    We discuss the effect of electron correlation on the unexpected differential sensitivity (UDS) in the 1J(C-H) coupling constant of CH4 using a decomposition into contributions from localized molecular orbitals and compare with the 1J(N-H) coupling constant in NH3. In particular we discuss the well...... known fact that uncorrelated coupled Hartree-Fock (CHF) calculations are not able to reproduce the UDS in methane. For this purpose we have implemented for the first time a localized molecular orbital analysis for the second order polarization propagator approximation with coupled cluster singles...... and doubles amplitudes - SOPPA(CCSD) in the DALTON program. Comparing the changes in the localized orbital contributions at the correlated SOPPA and SOPPA(CCSD) levels and at the uncorrelated CHF level, we find that the latter overestimates the effect of stretching the bond between the coupled atoms...

  12. Renormalization on noncommutative torus

    CERN Document Server

    D'Ascanio, D; Vassilevich, D V

    2016-01-01

    We study a self-interacting scalar $\\varphi^4$ theory on the $d$-dimensional noncommutative torus. We determine, for the particular cases $d=2$ and $d=4$, the nonlocal counterterms required by one-loop renormalization. We discuss higher loops in two dimensions and two-loop contributions to the self-energy in four dimensions. Our analysis points towards the absence of any problems related to the UV/IR mixing and thus to renormalizability of the theory. However, we find another potentially troubling phenomenon which is a wild behavior of the two-point amplitude as a function of the noncommutativity matrix $\\theta$.

  13. Renormalization of composite operators

    CERN Document Server

    Polonyi, J

    2001-01-01

    The blocked composite operators are defined in the one-component Euclidean scalar field theory, and shown to generate a linear transformation of the operators, the operator mixing. This transformation allows us to introduce the parallel transport of the operators along the RG trajectory. The connection on this one-dimensional manifold governs the scale evolution of the operator mixing. It is shown that the solution of the eigenvalue problem of the connection gives the various scaling regimes and the relevant operators there. The relation to perturbative renormalization is also discussed in the framework of the $\\phi^3$ theory in dimension $d=6$.

  14. Wavelets and renormalization

    CERN Document Server

    Battle, G A

    1999-01-01

    WAVELETS AND RENORMALIZATION describes the role played by wavelets in Euclidean field theory and classical statistical mechanics. The author begins with a stream-lined introduction to quantum field theory from a rather basic point of view. Functional integrals for imaginary-time-ordered expectations are introduced early and naturally, while the connection with the statistical mechanics of classical spin systems is introduced in a later chapter.A vastly simplified (wavelet) version of the celebrated Glimm-Jaffe construction of the F 4 3 quantum field theory is presented. It is due to Battle and

  15. Renormalization on noncommutative torus

    Energy Technology Data Exchange (ETDEWEB)

    D' Ascanio, D.; Pisani, P. [Universidad Nacional de La Plata, Instituto de Fisica La Plata-CONICET, La Plata (Argentina); Vassilevich, D.V. [Universidade Federal do ABC, CMCC, Santo Andre, SP (Brazil); Tomsk State University, Department of Physics, Tomsk (Russian Federation)

    2016-04-15

    We study a self-interacting scalar φ{sup 4} theory on the d-dimensional noncommutative torus. We determine, for the particular cases d = 2 and d = 4, the counterterms required by one-loop renormalization. We discuss higher loops in two dimensions and two-loop contributions to the self-energy in four dimensions. Our analysis points toward the absence of any problems related to the ultraviolet/infrared mixing and thus to renormalizability of the theory. However, we find another potentially troubling phenomenon which is a wild behavior of the two-point amplitude as a function of the noncommutativity matrix θ. (orig.)

  16. Renormalization on noncommutative torus

    Science.gov (United States)

    D'Ascanio, D.; Pisani, P.; Vassilevich, D. V.

    2016-04-01

    We study a self-interacting scalar \\varphi ^4 theory on the d-dimensional noncommutative torus. We determine, for the particular cases d=2 and d=4, the counterterms required by one-loop renormalization. We discuss higher loops in two dimensions and two-loop contributions to the self-energy in four dimensions. Our analysis points toward the absence of any problems related to the ultraviolet/infrared mixing and thus to renormalizability of the theory. However, we find another potentially troubling phenomenon which is a wild behavior of the two-point amplitude as a function of the noncommutativity matrix θ.

  17. Proposal for a running coupling JIMWLK equation

    CERN Document Server

    Lappi, T

    2014-01-01

    In the CGC framework the initial stages of a heavy ion collision at high energy are described as "glasma" field configurations. The initial condition for these evolving fields depends, in the CGC effective theory, on a probability distribution for color charges. The energy dependence of this distribution can be calculated from the JIMWLK renormalization group equation. We discuss recent work on a practical implementation of the running coupling constant in the Langevin method of solving the JIMWLK equation.

  18. Renormalization group for evolving networks.

    Science.gov (United States)

    Dorogovtsev, S N

    2003-04-01

    We propose a renormalization group treatment of stochastically growing networks. As an example, we study percolation on growing scale-free networks in the framework of a real-space renormalization group approach. As a result, we find that the critical behavior of percolation on the growing networks differs from that in uncorrelated networks.

  19. Setting the renormalization scale in QCD: The principle of maximum conformality

    DEFF Research Database (Denmark)

    Brodsky, S. J.; Di Giustino, L.

    2012-01-01

    the renormalization scale is set properly, all nonconformal beta not equal 0 terms in a perturbative expansion arising from renormalization are summed into the running coupling. The remaining terms in the perturbative series are then identical to that of a conformal theory; i.e., the corresponding theory with beta...... = 0. The resulting scale-fixed predictions using the principle of maximum conformality (PMC) are independent of the choice of renormalization scheme-a key requirement of renormalization group invariance. The results avoid renormalon resummation and agree with QED scale setting in the Abelian limit...

  20. A QCD sum rules calculation of the ηcD*D and ηc Ds* Ds form factors and strong coupling constants

    Science.gov (United States)

    Rodrigues, B. Osório; Bracco, M. E.; Zanetti, C. M.

    2017-10-01

    We use the QCD sum rules for the three point correlation functions to compute the strong coupling constants of the meson vertices ηcD* D and ηc Ds* Ds. We consider perturbative and non-perturbative contributions, working up to dimension five on the OPE. The vertices were studied considering that each one of its three mesons are off-shell alternately. The vertex coupling constant is evaluated through the extrapolation of the three different form factors. The results obtained for the coupling constants are gηcD*D =5.23-1.38+1.80 and g ηc Ds* Ds =5.55-1.55+1.29.

  1. On the calculation of nuclear spin-spin coupling constants. The bond length dependence of the Fermi contact term in H 2 and HD

    Science.gov (United States)

    Bacskay, George B.

    1995-08-01

    A theoretical study of the Fermi contact contribution to the HH and HD spin-spin coupling constant is reported, with special emphasis on its calculation using quantum chemical techniques over a wide range of internuclear distances, that has necessitated an extension of the existing methodology so the effects of near-degeneracy are properly treated. A detailed configuration interaction calculation on H 2 shows that as the molecule is stretched the coupling constant displays a sharp increase before decaying to zero as the molecule dissociates. Such distance dependence is reflected in the calculated vibrational averages of the coupling constant for HD that show a rapid increase with vibrational excitation.

  2. Computation of the Isotropic Hyperfine Coupling Constant: Efficiency and Insights from a New Approach Based on Wave Function Theory.

    Science.gov (United States)

    Giner, Emmanuel; Tenti, Lorenzo; Angeli, Celestino; Ferré, Nicolas

    2017-02-14

    The present paper reports an original computational strategy for the computation of the isotropic hyperfine coupling constants (hcc). The algorithm proposed here is based on an approach recently introduced by some of the authors, namely, the first-order breathing orbital self-consistent field (FOBO-SCF). The approach is an almost parameter-free wave function method capable to accurately treat the spin delocalization together with the spin polarization effects while staying in a restricted formalism and avoiding spin contamination. The efficiency of the method is tested on a series of small radicals, among which four nitroxide radicals and the comparison with high-level ab initio methods show very encouraging results. On the basis of these results, the method is then applied to compute the hcc of a challenging system, namely, the DEPMPO-OOH radical in various conformations. The reference values obtained on such a large system allows us to validate a cheap computational method based on density functional theory (DFT). Another interesting feature of the model applied here is that it allows for the rationalization of the results according to a relatively simple scheme based on a two-step mechanism. More precisely, the results are analyzed in terms of two separated contributions: first the spin delocalization and then the spin polarization.

  3. Measurement of multi-jet production cross sections, the strong coupling constant alphas and jet properties with the ATLAS detector

    CERN Document Server

    Cooper-Sarkar, Amanda; The ATLAS collaboration

    2016-01-01

    The production of multi­jet final states at hadron colliders probes pQCD at several mass scales. The processes can also be used to probe the gluon density function of the proton. The ATLAS collaboration has measured the production of 4­jets final states in in 20.3 /fb of data collected at a center­of­mass energy of 8 TeV. The measurements have been performed differentially as a function of a variety of kinematic and topological observables, amongst others the rapidity separation between the leading two jets. The results are compared with state­of­the­art theory calculations at NLO in pQCD, with the predictions of several MC generators as well as resummation calculations by in the HEJ approximation. The collaboration has also used multi­jets events in data taken at an effective integrated luminosity of 158 /pb at a center­of­mass energy of 7 TeV to measure the transverse energy correlation and its asymmetry and derive a measurement of the strong coupling constant. The average charge and the multiplic...

  4. Aspects of renormalization in finite-density field theory

    Energy Technology Data Exchange (ETDEWEB)

    Fitzpatrick, A. Liam; Torroba, Gonzalo; Wang, Huajia

    2015-05-26

    We study the renormalization of the Fermi surface coupled to a massless boson near three spatial dimensions. For this, we set up a Wilsonian RG with independent decimation procedures for bosons and fermions, where the four-fermion interaction “Landau parameters” run already at tree level. Our explicit one-loop analysis resolves previously found obstacles in the renormalization of finite-density field theory, including logarithmic divergences in nonlocal interactions and the appearance of multilogarithms. The key aspects of the RG are the above tree-level running, and a UV-IR mixing between virtual bosons and fermions at the quantum level, which is responsible for the renormalization of the Fermi velocity. We apply this approach to the renormalization of 2 k F singularities, and to Fermi surface instabilities in a companion paper, showing how multilogarithms are properly renormalized. We end with some comments on the renormalization of finite-density field theory with the inclusion of Landau damping of the boson.

  5. Energy-momentum tensor on the lattice: non-perturbative renormalization in Yang--Mills theory

    CERN Document Server

    Giusti, Leonardo

    2015-01-01

    We construct an energy-momentum tensor on the lattice which satisfies the appropriate Ward Identities (WIs) and has the right trace anomaly in the continuum limit. It is defined by imposing suitable WIs associated to the Poincare` invariance of the continuum theory. These relations come forth when the length of the box in the temporal direction is finite, and they take a particularly simple form if the coordinate and the periodicity axes are not aligned. We implement the method for the SU(3) Yang--Mills theory discretized with the standard Wilson action in presence of shifted boundary conditions in the (short) temporal direction. By carrying out extensive numerical simulations, the renormalization constants of the traceless components of the tensor are determined with a precision of roughly half a percent for values of the bare coupling constant in the range 0<= g^2_0<=1.

  6. NMR J-Coupling Constants of Tl-Pt Bonded Metal Complexes in Aqueous Solution: Ab Initio Molecular Dynamics and Localized Orbital Analysis.

    Science.gov (United States)

    Ducati, Lucas C; Marchenko, Alex; Autschbach, Jochen

    2016-11-21

    The influence of solvent (water) coordination and dynamics on the electronic structure and nuclear magnetic resonance (NMR) indirect spin-spin coupling (J-coupling) constants in a series of Tl-Pt bonded complexes is investigated using Kohn-Sham (KS) Car-Parrinello molecular dynamics (CPMD) and relativistic hybrid KS NMR calculations with and without coordination to water. Coordination of the Tl center by water molecules has a dramatic impact on (1)J(Tl-Pt) and other J-coupling constants. It is shown that a previous computational study of the same complexes using static optimized structures and nonhybrid functionals was correct about the important role of the solvent but obtained reasonable agreement with experimental NMR data because of a cancellation of substantial errors. For example, the CPMD trajectories show that on average the inner coordination shell of Tl is not saturated, as previously assumed, which leads to poor agreement with experiment when the J-coupling constants are averaged over the CPMD trajectories using NMR calculations with nonhybrid functionals. The combination of CPMD with hybrid KS NMR calculations provides a much more realistic computational model that reproduces the large magnitudes of (1)J(Tl-Pt) and the correct trends for other coupling constants. An analysis of (1)J(Tl-Pt) in terms of localized orbitals shows that the presence of coordinating water molecules increases the capacity for covalent interactions between Tl and Pt. There is pronounced multicenter bonding along the metal-metal axis of the complexes.

  7. Varying Constants

    CERN Document Server

    Damour, Thibault Marie Alban Guillaume

    2003-01-01

    We review some string-inspired theoretical models which incorporate a correlated spacetime variation of coupling constants while remaining naturally compatible both with phenomenological constraints coming from geochemical data (Oklo; Rhenium decay) and with present equivalence principle tests. Barring unnatural fine-tunings of parameters, a variation of the fine-structure constant as large as that recently ``observed'' by Webb et al. in quasar absorption spectra appears to be incompatible with these phenomenological constraints. Independently of any model, it is emphasized that the best experimental probe of varying constants are high-precision tests of the universality of free fall, such as MICROSCOPE and STEP. Recent claims by Bekenstein that fine-structure-constant variability does not imply detectable violations of the equivalence principle are shown to be untenable.

  8. Holographic interpretations of the renormalization group

    CERN Document Server

    Balasubramanian, Vijay; Lawrence, Albion

    2012-01-01

    In semiclassical holographic duality, the running couplings of a field theory are conventionally identified with the classical solutions of field equations in the dual gravitational theory. However, this identification is unclear when the bulk fields fluctuate. Recent work has used a Wilsonian framework to propose an alternative identification of the running couplings in terms of non-fluctuating data; in the classical limit, these new couplings do not satisfy the bulk equations of motion. We study renormalization scheme dependence in the latter formalism, and show that a scheme exists in which couplings to single trace operators realize particular solutions to the bulk equations of motion, in the semiclassical limit. This occurs for operators with dimension $\\Delta \

  9. Determination of magnitudes and relative signs of 1H-19F coupling constants through 1D- and 2D-TOCSY experiments.

    Science.gov (United States)

    Espinosa, Juan F

    2013-12-20

    A novel methodology based on 1D- and 2D-TOCSY experiments is described for a quick and accurate measurement of proton-fluorine coupling constants in fluorinated organic compounds. The magnitude of the (1)H-(19)F coupling was measured from the displacement between the relayed peaks associated with the α or β spin state of the fluorine, and its relative sign was derived from the sense of the displacement.

  10. Emergent geometry from field theory: Wilson's renormalization group revisited

    Science.gov (United States)

    Kim, Ki-Seok; Park, Chanyong

    2016-06-01

    We find a geometrical description from a field theoretical setup based on Wilson's renormalization group in real space. We show that renormalization group equations of coupling parameters encode the metric structure of an emergent curved space, regarded to be an Einstein equation for the emergent gravity. Self-consistent equations of local order-parameter fields with an emergent metric turn out to describe low-energy dynamics of a strongly coupled field theory, analogous to the Maxwell equation of the Einstein-Maxwell theory in the AdSd +2 /CFTd +1 duality conjecture. We claim that the AdS3 /CFT2 duality may be interpreted as Landau-Ginzburg theory combined with Wilson's renormalization group, which introduces vertex corrections into the Landau-Ginzburg theory in the large-Ns limit, where Ns is the number of fermion flavors.

  11. Electronic Raman scattering and the renormalization of the electron spectrum in LuB{sub 12}

    Energy Technology Data Exchange (ETDEWEB)

    Ponosov, Yu. S., E-mail: ponosov@imp.uran.ru; Streltsov, S. V., E-mail: streltsov@gmail.com [Russian Academy of Sciences, Institute of Metal Physics, Ural Branch (Russian Federation); Levchenko, A. V.; Filippov, V. B. [National Academy of Sciences of Ukraine, Frantsevich Institute of Materials Science Problems (Ukraine)

    2016-09-15

    The electronic Raman scattering in LuB{sub 12} single crystals of various isotope compositions is studied in the temperature range 10–650 K. The shape and the energy position of spectral maxima depend on the direction and magnitude of a probe wavevector, the temperature, and the excitation symmetry and remain unchanged when the isotope composition changes. Experimental spectra are compared with the spectra simulated on the basis of a calculated electronic structure. The experimental results are successfully described when the electron spectrum renormalization effects caused by electron–phonon coupling are taken into account. This confirms that the origin of the observed spectra in LuB{sub 12} is due to Raman scattering by electrons. A comparison of the calculated and experimental data makes it possible to determine the coupling constant (λ{sub ep} = 0.32) that gives the correct superconducting transition temperature.

  12. A path integral molecular dynamics study of the hyperfine coupling constants of the muoniated and hydrogenated acetone radicals

    Science.gov (United States)

    Oba, Yuki; Kawatsu, Tsutomu; Tachikawa, Masanori

    2016-08-01

    The on-the-fly ab initio density functional path integral molecular dynamics (PIMD) simulations, which can account for both the nuclear quantum effect and thermal effect, were carried out to evaluate the structures and "reduced" isotropic hyperfine coupling constants (HFCCs) for muoniated and hydrogenated acetone radicals (2-muoxy-2-propyl and 2-hydoxy-2-propyl) in vacuo. The reduced HFCC value from a simple geometry optimization calculation without both the nuclear quantum effect and thermal effect is -8.18 MHz, and that by standard ab initio molecular dynamics simulation with only the thermal effect and without the nuclear quantum effect is 0.33 MHz at 300 K, where these two methods cannot distinguish the difference between muoniated and hydrogenated acetone radicals. In contrast, the reduced HFCC value of the muoniated acetone radical by our PIMD simulation is 32.1 MHz, which is about 8 times larger than that for the hydrogenated radical of 3.97 MHz with the same level of calculation. We have found that the HFCC values are highly correlated with the local molecular structures; especially, the Mu—O bond length in the muoniated acetone radical is elongated due to the large nuclear quantum effect of the muon, which makes the expectation value of the HFCC larger. Although our PIMD result calculated in vacuo is about 4 times larger than the measured experimental value in aqueous solvent, the ratio of these HFCC values between muoniated and hydrogenated acetone radicals in vacuo is in reasonable agreement with the ratio of the experimental values in aqueous solvent (8.56 MHz and 0.9 MHz); the explicit presence of solvent molecules has a major effect on decreasing the reduced muon HFCC of in vacuo calculations for the quantitative reproduction.

  13. Coupling between protonation and conformation in cytochrome c oxidase: Insights from constant-pH MD simulations.

    Science.gov (United States)

    Oliveira, A Sofia F; Campos, Sara R R; Baptista, António M; Soares, Cláudio M

    2016-06-01

    Cytochrome c oxidases (CcOs) are the terminal enzymes of the respiratory chain in mitochondria and most bacteria. These enzymes reduce dioxygen (O(2)) to water and, simultaneously, generate a transmembrane electrochemical proton gradient. Despite their importance in the aerobic metabolism and the large amount of structural and biochemical data available for the A1-type CcO family, there is still no consensually accepted description of the molecular mechanisms operating in this protein. A substantial number of questions about the CcO's working mechanism remain to be answered, including how the protonation behavior of some key residues is modulated during a reduction cycle and how is the conformation of the protein affected by protonation. The main objective of this work was to study the protonation-conformation coupling in CcOs and identify the molecular factors that control the protonation state of some key residues. In order to directly capture the interplay between protonation and conformational effects, we have performed constant-pH MD simulations of an A1-type CcO inserted into a lipid bilayer in two redox states (oxidized and reduced) at physiological pH. From the simulations, we were able to identify several groups with unusual titration behavior that are highly dependent on the protein redox state, including the A-propionate from heme a and the D-propionate from heme a3, two key groups possibly involved in proton pumping. The protonation state of these two groups is heavily influenced by subtle conformational changes in the protein (notably of R481(I) and R482(I)) and by small changes in the hydrogen bond network.

  14. Fifty years of the renormalization group

    CERN Document Server

    Shirkov, D V

    2001-01-01

    Renormalization was the breakthrough that made quantum field theory respectable in the late 1940s. Since then, renormalization procedures, particularly the renormalization group method, have remained a touchstone for new theoretical developments. This work relates the history of the renormalization group. (17 refs).

  15. Practical Algebraic Renormalization

    CERN Document Server

    Grassi, P A; Steinhauser, M

    1999-01-01

    A practical approach is presented which allows the use of a non-invariant regularization scheme for the computation of quantum corrections in perturbative quantum field theory. The theoretical control of algebraic renormalization over non-invariant counterterms is translated into a practical computational method. We provide a detailed introduction into the handling of the Slavnov-Taylor and Ward-Takahashi identities in the Standard Model both in the conventional and the background gauge. Explicit examples for their practical derivation are presented. After a brief introduction into the Quantum Action Principle the conventional algebraic method which allows for the restoration of the functional identities is discussed. The main point of our approach is the optimization of this procedure which results in an enormous reduction of the calculational effort. The counterterms which have to be computed are universal in the sense that they are independent of the regularization scheme. The method is explicitly illustra...

  16. Gutzwiller renormalization group

    Science.gov (United States)

    Lanatà, Nicola; Yao, Yong-Xin; Deng, Xiaoyu; Wang, Cai-Zhuang; Ho, Kai-Ming; Kotliar, Gabriel

    2016-01-01

    We develop a variational scheme called the "Gutzwiller renormalization group" (GRG), which enables us to calculate the ground state of Anderson impurity models (AIM) with arbitrary numerical precision. Our method exploits the low-entanglement property of the ground state of local Hamiltonians in combination with the framework of the Gutzwiller wave function and indicates that the ground state of the AIM has a very simple structure, which can be represented very accurately in terms of a surprisingly small number of variational parameters. We perform benchmark calculations of the single-band AIM that validate our theory and suggest that the GRG might enable us to study complex systems beyond the reach of the other methods presently available and pave the way to interesting generalizations, e.g., to nonequilibrium transport in nanostructures.

  17. Renormalization Group Tutorial

    Science.gov (United States)

    Bell, Thomas L.

    2004-01-01

    Complex physical systems sometimes have statistical behavior characterized by power- law dependence on the parameters of the system and spatial variability with no particular characteristic scale as the parameters approach critical values. The renormalization group (RG) approach was developed in the fields of statistical mechanics and quantum field theory to derive quantitative predictions of such behavior in cases where conventional methods of analysis fail. Techniques based on these ideas have since been extended to treat problems in many different fields, and in particular, the behavior of turbulent fluids. This lecture will describe a relatively simple but nontrivial example of the RG approach applied to the diffusion of photons out of a stellar medium when the photons have wavelengths near that of an emission line of atoms in the medium.

  18. Tensor Network Renormalization.

    Science.gov (United States)

    Evenbly, G; Vidal, G

    2015-10-30

    We introduce a coarse-graining transformation for tensor networks that can be applied to study both the partition function of a classical statistical system and the Euclidean path integral of a quantum many-body system. The scheme is based upon the insertion of optimized unitary and isometric tensors (disentanglers and isometries) into the tensor network and has, as its key feature, the ability to remove short-range entanglement or correlations at each coarse-graining step. Removal of short-range entanglement results in scale invariance being explicitly recovered at criticality. In this way we obtain a proper renormalization group flow (in the space of tensors), one that in particular (i) is computationally sustainable, even for critical systems, and (ii) has the correct structure of fixed points, both at criticality and away from it. We demonstrate the proposed approach in the context of the 2D classical Ising model.

  19. Black holes and running couplings: A comparison of two complementary approaches

    CERN Document Server

    Koch, Benjamin; Rioseco, Paola; Saueressig, Frank

    2013-01-01

    Black holes appear as vacuum solutions of classical general relativity which depend on Newton's constant and possibly the cosmological constant. At the level of a quantum field theory, these coupling constants typically acquire a scale-dependence. This proceedings briefly summarizes two complementary ways to incorporate this effect: the renormalization group improvement of the classical black hole solution based on the running couplings obtained within the gravitational Asymptotic Safety program and the exact solution of the improved equations of motion including an arbitrary scale dependence of the gravitational couplings. Remarkably the picture of the "quantum" black holes obtained from these very different improvement strategies is surprisingly similar.

  20. Tensor Network Renormalization Yields the Multiscale Entanglement Renormalization Ansatz

    Science.gov (United States)

    Evenbly, G.; Vidal, G.

    2015-11-01

    We show how to build a multiscale entanglement renormalization ansatz (MERA) representation of the ground state of a many-body Hamiltonian H by applying the recently proposed tensor network renormalization [G. Evenbly and G. Vidal, Phys. Rev. Lett. 115, 180405 (2015)] to the Euclidean time evolution operator e-β H for infinite β . This approach bypasses the costly energy minimization of previous MERA algorithms and, when applied to finite inverse temperature β , produces a MERA representation of a thermal Gibbs state. Our construction endows tensor network renormalization with a renormalization group flow in the space of wave functions and Hamiltonians (and not merely in the more abstract space of tensors) and extends the MERA formalism to classical statistical systems.

  1. Tensor Network Renormalization Yields the Multiscale Entanglement Renormalization Ansatz.

    Science.gov (United States)

    Evenbly, G; Vidal, G

    2015-11-13

    We show how to build a multiscale entanglement renormalization ansatz (MERA) representation of the ground state of a many-body Hamiltonian H by applying the recently proposed tensor network renormalization [G. Evenbly and G. Vidal, Phys. Rev. Lett. 115, 180405 (2015)] to the Euclidean time evolution operator e(-βH) for infinite β. This approach bypasses the costly energy minimization of previous MERA algorithms and, when applied to finite inverse temperature β, produces a MERA representation of a thermal Gibbs state. Our construction endows tensor network renormalization with a renormalization group flow in the space of wave functions and Hamiltonians (and not merely in the more abstract space of tensors) and extends the MERA formalism to classical statistical systems.

  2. Analysis of the interactions between difluoroacetylene and one or two hydrogen fluoride molecules based on calculated spin–spin coupling constants

    DEFF Research Database (Denmark)

    Provasi, Patricio F.; Caputo, María Cristina; Sauer, Stephan P. A.

    2012-01-01

    A theoretical study of FCCF:(HF)n complexes, with n = 1 and 2, has been carried out by means of ab initio computational methods. Two types of complexes are formed: those with FH···p interactions and those with FH···FC hydrogen bonds. The indirect spin–spin coupling constants have been calculated ...

  3. Study of the Pion-Nucleon Coupling Constant Charge Dependence on the Basis of the Low-Energy Data on Nucleon-Nucleon Interaction

    CERN Document Server

    Babenko, V A

    2016-01-01

    We study relationship between the physical quantities that characterize pion-nucleon and nucleon-nucleon interaction on the basis of the fact that nuclear forces in the nucleon-nucleon system at low energies are mainly determined by the one-pion exchange mechanism. By making use of the recommended proton-proton low-energy scattering parameters, we obtain the following value for the charged pion-nucleon coupling constant g$_{\\pi ^{\\pm }}^{2}/4\\pi =14.55(13)$. Calculated value of this quantity is in excellent agreement with the experimental result g$_{\\pi ^{\\pm }}^{2}/4\\pi =14.52(26)$ of the Uppsala Neutron Research Group. At the same time, the obtained value of the charged pion-nucleon coupling constant differs markedly from the value of the neutral pion-nucleon coupling constant g$_{\\pi ^{0}}^{2}/4\\pi =13.55(13)$. Thus, our results show considerable charge splitting of the pion-nucleon coupling constant.

  4. Decay coupling constants sum rules for dibaryon octet into two baryon octets with $\\lambda_8$ first order SU(3) symmetry breaking

    CERN Document Server

    Polanco-Euán, E N; Sánchez-Colón, G; Bambah, B A

    2016-01-01

    The SU(3) octet states with baryon number B = 2, hexaquark dibaryons, are considered. Decay coupling constants sum rules for dibaryon octet into two ordinary baryon octets with ?$\\lambda_8$ first order SU(3) symmetry breaking are given. An SU(4) extension of the analysis is commented upon. Possibilities for the experimental observation of multibaryon and anti-multibaryon states are pointed out.

  5. Spin-orbit corrections to the indirect nuclear spin-spin coupling constants in XH4 (X=C, Si, Ge, and Sn)

    DEFF Research Database (Denmark)

    Kirpekar, Sheela; Jensen, Hans Jørgen Aagaard; Oddershede, Jens

    1997-01-01

    Using the quadratic response function at the ab initio SCF level of approximation we have calculated the relativistic corrections from the spin-orbit Hamiltonian, HSO, to the indirect nuclear spin-spin coupling constants of XH4 (X = C, Si, Ge, and Sn). We find that the spin-orbit contributions to...

  6. The exact renormalization group and approximation solutions

    CERN Document Server

    Morris, T R

    1994-01-01

    We investigate the structure of Polchinski's formulation of the flow equations for the continuum Wilson effective action. Reinterpretations in terms of I.R. cutoff greens functions are given. A promising non-perturbative approximation scheme is derived by carefully taking the sharp cutoff limit and expanding in `irrelevancy' of operators. We illustrate with two simple models of four dimensional $\\lambda \\varphi^4$ theory: the cactus approximation, and a model incorporating the first irrelevant correction to the renormalized coupling. The qualitative and quantitative behaviour give confidence in a fuller use of this method for obtaining accurate results.

  7. Inverse scattering theory: renormalization of the Lippmann-Schwinger equation for acoustic scattering in one dimension.

    Science.gov (United States)

    Kouri, Donald J; Vijay, Amrendra

    2003-04-01

    The most robust treatment of the inverse acoustic scattering problem is based on the reversion of the Born-Neumann series solution of the Lippmann-Schwinger equation. An important issue for this approach to inversion is the radius of convergence of the Born-Neumann series for Fredholm integral kernels, and especially for acoustic scattering for which the interaction depends on the square of the frequency. By contrast, it is well known that the Born-Neumann series for the Volterra integral equations in quantum scattering are absolutely convergent, independent of the strength of the coupling characterizing the interaction. The transformation of the Lippmann-Schwinger equation from a Fredholm to a Volterra structure by renormalization has been considered previously for quantum scattering calculations and electromagnetic scattering. In this paper, we employ the renormalization technique to obtain a Volterra equation framework for the inverse acoustic scattering series, proving that this series also converges absolutely in the entire complex plane of coupling constant and frequency values. The present results are for acoustic scattering in one dimension, but the method is general. The approach is illustrated by applications to two simple one-dimensional models for acoustic scattering.

  8. On the truncation of the number of excited states in density functional theory sum-over-states calculations of indirect spin spin coupling constants

    DEFF Research Database (Denmark)

    Zarycz, M. Natalia C.; Provasi, Patricio F.; Sauer, Stephan P. A.

    2015-01-01

    It is investigated, whether the number of excited (pseudo)states can be truncated in the sum-over-states expression for indirect spin-spin coupling constants (SSCC), which is used in the Contributions from Localized Orbitals within the Polarization Propagator Approach and Inner Projections......-correlation functional and the specialized core-property basis set, aug-cc-pVTZ-J. We investigated both how the calculated coupling constants depend on the number of (pseudo)states included in the summation and whether the summation can be truncated in a systematic way at a smaller number of states and extrapolated...... to the total number of (pseudo)states for the given one-electron basis set. We find that this is possible and that for some of the couplings it is sufficient to include only about 30% of the excited (pseudo)states....

  9. Lorentz space estimates for the Coulombian renormalized energy

    CERN Document Server

    Serfaty, Sylvia

    2011-01-01

    In this paper we obtain optimal estimates for the "currents" associated to point masses in the plane, in terms of the Coulombian renormalized energy of Sandier-Serfaty \\cite{ss1,ss3}. To derive the estimates, we use a technique that we introduced in \\cite{st}, which couples the "ball construction method" to estimates in the Lorentz space $L^{2,\\infty}$.

  10. Renormalization automated by Hopf algebra

    CERN Document Server

    Broadhurst, D J

    1999-01-01

    It was recently shown that the renormalization of quantum field theory is organized by the Hopf algebra of decorated rooted trees, whose coproduct identifies the divergences requiring subtraction and whose antipode achieves this. We automate this process in a few lines of recursive symbolic code, which deliver a finite renormalized expression for any Feynman diagram. We thus verify a representation of the operator product expansion, which generalizes Chen's lemma for iterated integrals. The subset of diagrams whose forest structure entails a unique primitive subdivergence provides a representation of the Hopf algebra ${\\cal H}_R$ of undecorated rooted trees. Our undecorated Hopf algebra program is designed to process the 24,213,878 BPHZ contributions to the renormalization of 7,813 diagrams, with up to 12 loops. We consider 10 models, each in 9 renormalization schemes. The two simplest models reveal a notable feature of the subalgebra of Connes and Moscovici, corresponding to the commutative part of the Hopf ...

  11. Chaotic renormalization-group trajectories

    DEFF Research Database (Denmark)

    Damgaard, Poul H.; Thorleifsson, G.

    1991-01-01

    , or in regions where the renormalization-group flow becomes chaotic. We present some explicit examples of these phenomena for the case of a Lie group valued spin-model analyzed by means of a variational real-space renormalization group. By directly computing the free energy of these models around the parameter......Under certain conditions, the renormalization-group flow of models in statistical mechanics can change dramatically under just very small changes of given external parameters. This can typically occur close to bifurcations of fixed points, close to the complete disappearance of fixed points...... regions in which such nontrivial modifications of the renormalization-group flow occur, we can extract the physical consequences of these phenomena....

  12. Differential renormalization of gauge theories

    Energy Technology Data Exchange (ETDEWEB)

    Aguila, F. del; Perez-Victoria, M. [Dept. de Fisica Teorica y del Cosmos, Universidad de Granada, Granada (Spain)

    1998-10-01

    The scope of constrained differential renormalization is to provide renormalized expressions for Feynman graphs, preserving at the same time the Ward identities of the theory. It has been shown recently that this can be done consistently at least to one loop for Abelian and non-Abelian gauge theories. We briefly review these results, evaluate as an example the gluon self energy in both coordinate and momentum space, and comment on anomalies. (author) 9 refs, 1 fig., 1 tab

  13. Holographic renormalization in teleparallel gravity

    Energy Technology Data Exchange (ETDEWEB)

    Krssak, Martin [Universidade Estadual Paulista, Instituto de Fisica Teorica, Sao Paulo, SP (Brazil)

    2017-01-15

    We consider the problem of IR divergences of the action in the covariant formulation of teleparallel gravity in asymptotically Minkowski spacetimes. We show that divergences are caused by inertial effects and can be removed by adding an appropriate surface term, leading to the renormalized action. This process can be viewed as a teleparallel analog of holographic renormalization. Moreover, we explore the variational problem in teleparallel gravity and explain how the variation with respect to the spin connection should be performed. (orig.)

  14. Renormalization and resolution of singularities

    OpenAIRE

    Bergbauer, Christoph; Brunetti, Romeo; Kreimer, Dirk

    2009-01-01

    Since the seminal work of Epstein and Glaser it is well established that perturbative renormalization of ultraviolet divergences in position space amounts to extension of distributions onto diagonals. For a general Feynman graph the relevant diagonals form a nontrivial arrangement of linear subspaces. One may therefore ask if renormalization becomes simpler if one resolves this arrangement to a normal crossing divisor. In this paper we study the extension problem of distributions onto the won...

  15. Brane Couplings from Bulk Loops

    OpenAIRE

    Georgi, Howard; Grant, Aaron K.; Hailu, Girma

    2000-01-01

    We compute loop corrections to the effective action of a field theory on a five-dimensional $S_1/Z_2$ orbifold. We find that the quantum loop effects of interactions in the bulk produce infinite contributions that require renormalization by four-dimensional couplings on the orbifold fixed planes. Thus bulk couplings give rise to renormalization group running of brane couplings.

  16. Isotope effects and the temperature dependences of the hyperfine coupling constants of muoniated sec-butyl radicals in condensed phases.

    Science.gov (United States)

    Fleming, Donald G; Bridges, Michael D; Arseneau, Donald J; Chen, Ya Kun; Wang, Yan Alexander

    2011-04-01

    Reported here is the first μSR study of the muon (A(μ)) and proton (A(p)) β-hyperfine coupling constants (Hfcc) of muoniated sec-butyl radicals, formed by muonium (Mu) addition to 1-butene and to cis- and trans-2-butene. The data are compared with in vacuo spin-unrestricted MP2 and hybrid DFT/B3YLP calculations reported in the previous paper (I), which played an important part in the interpretation of the data. The T-dependences of both the (reduced) muon, A(μ)′(T), and proton, A(p)(T), Hfcc are surprisingly well explained by a simple model, in which the calculated Hfcc from paper I at energy minima of 0 and near ±120° are thermally averaged, assuming an energy dependence given by a basic 2-fold torsional potential. Fitted torsional barriers to A(μ)′(T) from this model are similar (~3 kJ/mol) for all muoniated butyl radicals, suggesting that these are dominated by ZPE effects arising from the C−Mu bond, but for A(p)(T) exhibit wide variations depending on environment. For the cis- and trans-2-butyl radicals formed from 2-butene, A(μ)′(T) exhibits clear discontinuities at bulk butene melting points, evidence for molecular interactions enhancing these muon Hfcc in the environment of the solid state, similar to that found in earlier reports for muoniated tert-butyl. In contrast, for Mu−sec-butyl formed from 1-butene, there is no such discontinuity. The muon hfcc for the trans-2-butyl radical are seemingly very well predicted by B3LYP calculations in the solid phase, but for sec-butyl from 1-butene, showing the absence of further interactions, much better agreement is found with the MP2 calculations across the whole temperature range. Examples of large proton Hfcc near 0 K are also reported, due to eclipsed C−H bonds, in like manner to C−Mu, which then also exhibit clear discontinuities in A(p)(T) at bulk melting points. The data suggest that the good agreement found between theory and experiment from the B3LYP calculations for eclipsed bonds in

  17. Communication: Localized molecular orbital analysis of the effect of electron correlation on the anomalous isotope effect in the NMR spin-spin coupling constant in methane

    Energy Technology Data Exchange (ETDEWEB)

    Zarycz, M. Natalia C., E-mail: mnzarycz@gmail.com; Provasi, Patricio F., E-mail: patricio@unne.edu.ar [Department of Physics, University of Northeastern - CONICET, Av. Libertad 5500, Corrientes W3404AAS (Argentina); Sauer, Stephan P. A., E-mail: sauer@kiku.dk [Department of Chemistry, University of Copenhagen, Universitetsparken 5, DK-2100 Copenhagen Ø (Denmark)

    2014-10-21

    We discuss the effect of electron correlation on the unexpected differential sensitivity (UDS) in the {sup 1}J(C–H) coupling constant of CH{sub 4} using a decomposition into contributions from localized molecular orbitals and compare with the {sup 1}J(N–H) coupling constant in NH{sub 3}. In particular, we discuss the well known fact that uncorrelated coupled Hartree-Fock (CHF) calculations are not able to reproduce the UDS in methane. For this purpose we have implemented for the first time a localized molecular orbital analysis for the second order polarization propagator approximation with coupled cluster singles and doubles amplitudes—SOPPA(CCSD) in the DALTON program. Comparing the changes in the localized orbital contributions at the correlated SOPPA and SOPPA(CCSD) levels and at the uncorrelated CHF level, we find that the latter overestimates the effect of stretching the bond between the coupled atoms on the contribution to the coupling from the localized bonding orbital between these atoms. This disturbs the subtle balance between the molecular orbital contributions, which lead to the UDS in methane.

  18. Structure constants of planar N =4 Yang Mills at one loop

    CERN Document Server

    Alday, L F; Gava, E; Narain, K S; Alday, Luis F.; David, Justin R.; Gava, Edi

    2005-01-01

    We study structure constants of gauge invariant operators in planar N=4 Yang-Mills at one loop with the motivation of determining features of the string dual of weak coupling Yang-Mills. We derive a simple renormalization group invariant formula characterizing the corrections to structure constants of any primary operator in the planar limit. Applying this to the scalar SO(6) sector we find that the one loop corrections to structure constants of gauge invariant operators is determined by the one loop anomalous dimension Hamiltonian in this sector. We then evaluate the one loop corrections to structure constants for scalars with arbitrary number of derivatives in a given holomorphic direction. We find that the corrections can be characterized by suitable derivatives on the four point tree function of a massless scalar with quartic coupling. We show that individual diagrams violating conformal invariance can be combined together to restore it using a linear inhomogeneous partial differential equation satisfied ...

  19. Fingerprinting the extended Higgs sector using one-loop corrected Higgs boson couplings and future precision measurements

    Directory of Open Access Journals (Sweden)

    Shinya Kanemura

    2015-07-01

    Full Text Available We calculate radiative corrections to a full set of coupling constants for the 125 GeV Higgs boson at the one-loop level in two Higgs doublet models with four types of Yukawa interaction under the softly-broken discrete Z2 symmetry. The renormalization calculations are performed in the on-shell scheme, in which the gauge dependence in the mixing parameter which appears in the previous calculation is consistently avoided. We first show the details of our renormalization scheme, and present the complete set of the analytic formulae of the renormalized couplings. We then numerically demonstrate how the inner parameters of the model can be extracted by the future precision measurements of these couplings at the high luminosity LHC and the International Linear Collider.

  20. Renormalization of an Abelian Tensor Group Field Theory: Solution at Leading Order

    CERN Document Server

    Lahoche, Vincent; Rivasseau, Vincent

    2015-01-01

    We study a just renormalizable tensorial group field theory of rank six with quartic melonic interactions and Abelian group U(1). We introduce the formalism of the intermediate field, which allows a precise characterization of the leading order Feynman graphs. We define the renormalization of the model, compute its (perturbative) renormalization group flow and write its expansion in terms of effective couplings. We then establish closed equations for the two point and four point functions at leading (melonic) order. Using the effective expansion and its uniform exponential bounds we prove that these equations admit a unique solution at small renormalized coupling.

  1. Full counting statistics of level renormalization in electron transport through double quantum dots.

    Science.gov (United States)

    Luo, JunYan; Jiao, HuJun; Shen, Yu; Cen, Gang; He, Xiao-Ling; Wang, Changrong

    2011-04-13

    We examine the full counting statistics of electron transport through double quantum dots coupled in series, with particular attention being paid to the unique features originating from level renormalization. It is clearly illustrated that the energy renormalization gives rise to a dynamic charge blockade mechanism, which eventually results in super-Poissonian noise. Coupling of the double dots to an external heat bath leads to dephasing and relaxation mechanisms, which are demonstrated to suppress the noise in a unique way.

  2. Full counting statistics of level renormalization in electron transport through double quantum dots

    Energy Technology Data Exchange (ETDEWEB)

    Luo Junyan; Shen Yu; Cen Gang; He Xiaoling; Wang Changrong [School of Science, Zhejiang University of Science and Technology, Hangzhou 310023 (China); Jiao Hujun, E-mail: jyluo@zust.edu.cn [Department of Physics, Shanxi University, Taiyuan, Shanxi 030006 (China)

    2011-04-13

    We examine the full counting statistics of electron transport through double quantum dots coupled in series, with particular attention being paid to the unique features originating from level renormalization. It is clearly illustrated that the energy renormalization gives rise to a dynamic charge blockade mechanism, which eventually results in super-Poissonian noise. Coupling of the double dots to an external heat bath leads to dephasing and relaxation mechanisms, which are demonstrated to suppress the noise in a unique way.

  3. The analytic renormalization group

    Directory of Open Access Journals (Sweden)

    Frank Ferrari

    2016-08-01

    Full Text Available Finite temperature Euclidean two-point functions in quantum mechanics or quantum field theory are characterized by a discrete set of Fourier coefficients Gk, k∈Z, associated with the Matsubara frequencies νk=2πk/β. We show that analyticity implies that the coefficients Gk must satisfy an infinite number of model-independent linear equations that we write down explicitly. In particular, we construct “Analytic Renormalization Group” linear maps Aμ which, for any choice of cut-off μ, allow to express the low energy Fourier coefficients for |νk|<μ (with the possible exception of the zero mode G0, together with the real-time correlators and spectral functions, in terms of the high energy Fourier coefficients for |νk|≥μ. Operating a simple numerical algorithm, we show that the exact universal linear constraints on Gk can be used to systematically improve any random approximate data set obtained, for example, from Monte-Carlo simulations. Our results are illustrated on several explicit examples.

  4. The analytic renormalization group

    Science.gov (United States)

    Ferrari, Frank

    2016-08-01

    Finite temperature Euclidean two-point functions in quantum mechanics or quantum field theory are characterized by a discrete set of Fourier coefficients Gk, k ∈ Z, associated with the Matsubara frequencies νk = 2 πk / β. We show that analyticity implies that the coefficients Gk must satisfy an infinite number of model-independent linear equations that we write down explicitly. In particular, we construct "Analytic Renormalization Group" linear maps Aμ which, for any choice of cut-off μ, allow to express the low energy Fourier coefficients for |νk | < μ (with the possible exception of the zero mode G0), together with the real-time correlators and spectral functions, in terms of the high energy Fourier coefficients for |νk | ≥ μ. Operating a simple numerical algorithm, we show that the exact universal linear constraints on Gk can be used to systematically improve any random approximate data set obtained, for example, from Monte-Carlo simulations. Our results are illustrated on several explicit examples.

  5. The two dimensional N=(2,2) Wess-Zumino Model in the Functional Renormalization Group Approach

    OpenAIRE

    Synatschke-Czerwonka, Franziska; Fischbacher, Thomas; Bergner, Georg

    2010-01-01

    We study the supersymmetric N=(2,2) Wess-Zumino model in two dimensions with the functional renormalization group. At leading order in the supercovariant derivative expansion we recover the nonrenormalization theorem which states that the superpotential has no running couplings. Beyond leading order the renormalization of the bare mass is caused by a momentum dependent wave function renormalization. To deal with the partial differential equations we have developed a numerical toolbox called F...

  6. Analytical Determination of the Confinement Potential and Coupling Constant of Spin--Orbit Interactions of Electrons in Nanostructures

    CERN Document Server

    Dineykhan, M; Zhaugasheva, S A; Al Farabi Kazakh State National University. Almaty

    2005-01-01

    Multilayer nanocrystalline structure is represented by the electrostatic field inducted by total image charge, and the confinement potential for electrons is determined. Assuming that at a given distance the confinement potential is equal to the Coulomb repulsion and an interaction between electrons becomes spin-orbit, the constant of the spin-orbit interaction of electrons in nanostructures is determined. The dependence of the constant of the spin-orbit interaction on environment parameters and the distance between electrons is studied.

  7. Communication: Spin densities within a unitary group based spin-adapted open-shell coupled-cluster theory: Analytic evaluation of isotropic hyperfine-coupling constants for the combinatoric open-shell coupled-cluster scheme

    Energy Technology Data Exchange (ETDEWEB)

    Datta, Dipayan, E-mail: datta.dipayan@gmail.com; Gauss, Jürgen, E-mail: gauss@uni-mainz.de [Institut für Physikalische Chemie, Johannes Gutenberg-Universität Mainz, Duesbergweg 10-14, D-55128 Mainz (Germany)

    2015-07-07

    We report analytical calculations of isotropic hyperfine-coupling constants in radicals using a spin-adapted open-shell coupled-cluster theory, namely, the unitary group based combinatoric open-shell coupled-cluster (COSCC) approach within the singles and doubles approximation. A scheme for the evaluation of the one-particle spin-density matrix required in these calculations is outlined within the spin-free formulation of the COSCC approach. In this scheme, the one-particle spin-density matrix for an open-shell state with spin S and M{sub S} = + S is expressed in terms of the one- and two-particle spin-free (charge) density matrices obtained from the Lagrangian formulation that is used for calculating the analytic first derivatives of the energy. Benchmark calculations are presented for NO, NCO, CH{sub 2}CN, and two conjugated π-radicals, viz., allyl and 1-pyrrolyl in order to demonstrate the performance of the proposed scheme.

  8. Renormalization-group flows and fixed points in Yukawa theories

    DEFF Research Database (Denmark)

    Mølgaard, Esben; Shrock, R.

    2014-01-01

    We study renormalization-group flows in Yukawa theories with massless fermions, including determination of fixed points and curves that separate regions of different flow behavior. We assess the reliability of perturbative calculations for various values of Yukawa coupling y and quartic scalar....... In the regime of weak couplings where the perturbative calculations are most reliable, we find that the theories have no nontrivial fixed points, and the flow is toward a free theory in the infrared....

  9. Direct determination of rate constants for coupling between aromatic radical anions and alkyl and benzyl radicals by laser-flash photolysis

    DEFF Research Database (Denmark)

    Lund, T.; Christensen, P.; Wilbrandt, Robert Walter

    2003-01-01

    Coupling rates between the radicals methyl, n-, sec-, tert-butyl and benzyl (R-.) and the aromatic radical anions of 1,4-dicyanonaphthalene, 9,10-dicyanoanthracene and fluorenone (A(-.)) have been obtained using a new laser-flash photolysis method. The radicals R-. and the radical anions A(-.) were...... generated by a photoinduced electron transfer reaction between the aromatic compound A and the alkyl or benzyl triphenylborate anion RB(Ph)(3)(-). For the first time the rate constants of the coupling reaction between methyl and benzyl radicals with aromatic radical anions have been obtained. For all...... of the radicals and the structure and standard potentials of the aromatic radical anions....

  10. Running with rugby balls: bulk renormalization of codimension-2 branes

    Science.gov (United States)

    Williams, M.; Burgess, C. P.; van Nierop, L.; Salvio, A.

    2013-01-01

    We compute how one-loop bulk effects renormalize both bulk and brane effective interactions for geometries sourced by codimension-two branes. We do so by explicitly integrating out spin-zero, -half and -one particles in 6-dimensional Einstein-Maxwell-Scalar theories compactified to 4 dimensions on a flux-stabilized 2D geometry. (Our methods apply equally well for D dimensions compactified to D - 2 dimensions, although our explicit formulae do not capture all divergences when D > 6.) The renormalization of bulk interactions are independent of the boundary conditions assumed at the brane locations, and reproduce standard heat-kernel calculations. Boundary conditions at any particular brane do affect how bulk loops renormalize this brane's effective action, but not the renormalization of other distant branes. Although we explicitly compute our loops using a rugby ball geometry, because we follow only UV effects our results apply more generally to any geometry containing codimension-two sources with conical singularities. Our results have a variety of uses, including calculating the UV sensitivity of one-loop vacuum energy seen by observers localized on the brane. We show how these one-loop effects combine in a surprising way with bulk back-reaction to give the complete low-energy effective cosmological constant, and comment on the relevance of this calculation to proposed applications of codimension-two 6D models to solutions of the hierarchy and cosmological constant problems.

  11. Determination of the strong coupling constant from the inclusive jet cross section in ppbar collisions at sqrt(s)=1.96 TeV

    Energy Technology Data Exchange (ETDEWEB)

    Abazov, V.M.; /Dubna, JINR; Abbott, B.; /Oklahoma U.; Abolins, M.; /Michigan State U.; Acharya, B.S.; /Tata Inst.; Adams, M.; /Illinois U., Chicago; Adams, T.; /Florida State U.; Aguilo, E.; /Alberta U. /Simon Fraser U. /York U., Canada /McGill U.; Ahsan, M.; /Kansas State U.; Alexeev, G.D.; /Dubna, JINR; Alkhazov, G.; /St. Petersburg, INP; Alton, A.; /Michigan U. /Northeastern U.

    2009-11-01

    We determine the strong coupling constant {alpha}{sub s} and its energy dependence from the p{sub T} dependence of the inclusive jet cross section in p{bar p} collisions at {radical}s = 1.96 TeV. The strong coupling constant is determined over the transverse momentum range 50 < p{sub T} < 145 GeV. Using perturbative QCD calculations to order {Omicron}({alpha}{sub s}{sup 3}) combined with {Omicron}({alpha}{sub s}{sup 4}) contributions from threshold corrections, we obtain {alpha}{sub s}(M{sub Z}) = 0.1173{sub -0.0049}{sup +0.0041}. This is the most precise result obtained at a hadron-hadron collider.

  12. Eliminating the Renormalization Scale Ambiguity for Top-Pair Production Using the Principle of Maximum Conformality

    CERN Document Server

    Brodsky, Stanley J

    2012-01-01

    The uncertainty in setting the renormalization scale in finite-order perturbative QCD predictions using standard methods substantially reduces the precision of tests of the Standard Model in collider experiments. It is conventional to choose a typical momentum transfer of the process as the renormalization scale and take an arbitrary range to estimate the uncertainty in the QCD prediction. However, predictions using this procedure depend on the choice of renormalization scheme, and moreover, one obtains incorrect results when applied to QED processes. In contrast, if one fixes the renormalization scale using the Principle of Maximum Conformality (PMC), all non-conformal $\\{\\beta_i\\}$-terms in the perturbative expansion series are summed into the running coupling, and one obtains a unique, scale-fixed, scheme-independent prediction at any finite order. The PMC renormalization scale $\\mu^{\\rm PMC}_R$ and the resulting finite-order PMC prediction are both to high accuracy independent of choice of the initial ren...

  13. Vicinal 1H-1H NMR coupling constants from density functional theory as reliable tools for stereochemical analysis of highly flexible multichiral center molecules.

    Science.gov (United States)

    López-Vallejo, Fabian; Fragoso-Serrano, Mabel; Suárez-Ortiz, Gloria Alejandra; Hernández-Rojas, Adriana C; Cerda-García-Rojas, Carlos M; Pereda-Miranda, Rogelio

    2011-08-05

    A protocol for stereochemical analysis, based on the systematic comparison between theoretical and experimental vicinal (1)H-(1)H NMR coupling constants, was developed and applied to a series of flexible compounds (1-8) derived from the 6-heptenyl-5,6-dihydro-2H-pyran-2-one framework. The method included a broad conformational search, followed by geometry optimization at the DFT B3LYP/DGDZVP level, calculation of the vibrational frequencies, thermochemical parameters, magnetic shielding tensors, and the total NMR spin-spin coupling constants. Three scaling factors, depending on the carbon atom hybridizations, were found for the (1)H-C-C-(1)H vicinal coupling constants: f((sp3)-(sp3)) = 0.910, f((sp3)-(sp2)) = 0.929, and f((sp2)-(sp2))= 0.977. A remarkable correlation between the theoretical (J(pre)) and experimental (1)H-(1)H NMR (J(exp)) coupling constants for spicigerolide (1), a cytotoxic natural product, and some of its synthetic stereoisomers (2-4) demonstrated the predictive value of this approach for the stereochemical assignment of highly flexible compounds containing multiple chiral centers. The stereochemistry of two natural 6-heptenyl-5,6-dihydro-2H-pyran-2-ones (14 and 15) containing diverse functional groups in the heptenyl side chain was also analyzed by application of this combined theoretical and experimental approach, confirming its reliability. Additionally, a geometrical analysis for the conformations of 1-8 revealed that weak hydrogen bonds substantially guide the conformational behavior of the tetraacyloxy-6-heptenyl-2H-pyran-2-ones.

  14. Experimental Determination of Pseudorotation Potentials for Disubstituted Cyclopentanes Based on Spin–Spin Coupling Constants

    Directory of Open Access Journals (Sweden)

    Vyacheslav A. Chertkov

    2003-02-01

    Full Text Available Abstract: Complete analysis of 1H-NMR spectra of trans-1,2-dichlorocyclopentane and trans-1,2-dibromocyclopentane was performed with use of our total lineshape fitting algorithm VALISA. The resulting high precision spin-spin coupling constants were then applied to the problem of conformational analysis, yielding a continuos potential of pseudorotation for the studied compounds in CDCl3, CCl4, and CD3CN solutions.

  15. Decoupling constant for $\\alpha_s$ and the effective gluon-Higgs coupling to three loops in supersymmetric QCD

    CERN Document Server

    Kurz, Alexander; Zerf, Nikolai

    2012-01-01

    We compute the three-loop QCD corrections to the decoupling constant for $\\alpha_s$ which relates the Minimal Supersymmetric Standard Model to Quantum Chromodynamics with five or six active flavours. The new results can be used to study the stability of $\\alpha_s$ evaluated at a high scale from the knowledge of its value at $M_Z$. We furthermore derive a low-energy theorem which allows the calculation of the coefficient function of the effective Higgs boson-gluon operator from the decoupling constant. This constitutes the first independent check of the matching coefficient to three loops.

  16. A user-friendly Matlab program and GUI for the pseudorotation analysis of saturated five-membered ring systems based on scalar coupling constants

    Directory of Open Access Journals (Sweden)

    Martins José C

    2008-10-01

    Full Text Available Abstract Background The advent of combinatorial chemistry has revived the interest in five-membered heterocyclic rings as scaffolds in pharmaceutical research. They are also the target of modifications in nucleic acid chemistry. Hence, the characterization of their conformational features is of considerable interest. This can be accomplished from the analysis of the 3JHH scalar coupling constants. Results A freely available program including an easy-to-use graphical user interface (GUI has been developed for the calculation of five-membered ring conformations from scalar coupling constant data. A variety of operational modes and parameterizations can be selected by the user, and the coupling constants and electronegativity parameters can be defined interactively. Furthermore, the possibility of generating high-quality graphical output of the conformational space accessible to the molecule under study facilitates the interpretation of the results. These features are illustrated via the conformational analysis of two 4'-thio-2'-deoxynucleoside analogs. Results are discussed and compared with those obtained using the original PSEUROT program. Conclusion A user-friendly Matlab interface has been developed and tested. This should considerably improve the accessibility of this kind of calculations to the chemical community.

  17. Holographic RG flows for gravitational couplings

    Energy Technology Data Exchange (ETDEWEB)

    Rachwal, L. [ICTP, Strada Costiera 11, 34014 Trieste (Italy); SISSA, via Bonomea 265, 34136 Trieste (Italy); Percacci, R. [SISSA, via Bonomea 265, 34136 Trieste (Italy)

    2014-09-11

    We present the first attempt to find the holographic interpretation of running of the Newton's constant in 4-dimensional quantum theory. We compute its scale-dependence using functional renormalization group methods based on a Wilsonian momentum cutoff. We show the details of the corresponding holographic RG flow in 5-dimensional spacetime with minimally coupled scalar field in the bulk. In this domain wall setup the scalar potential is found. Solutions of this theory describe RG flows of gravitational coupling with the IR threshold phenomena fully taken into account. (Copyright copyright 2014 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  18. Renormalization of the momentum density on the lattice using shifted boundary conditions

    CERN Document Server

    Robaina, Daniel

    2013-01-01

    In order to extract transport quantities from energy-momentum-tensor (EMT) correlators in Lattice QCD there is a strong need for a non-perturbative renormalization of these operators. This is due to the fact that the lattice regularization explicitly breaks translational invariance, invalidating the non-renormalization-theorem. Here we present a non-perturbative calculation of the renormalization constant of the off-diagonal components of the EMT in SU(3) pure gauge theory using lattices with shifted boundary conditions. This allows us to induce a non-zero momentum in the system controlled by the shift parameter and to determine the normalization of the momentum density operator.

  19. The renormalization scale-setting problem in QCD

    Energy Technology Data Exchange (ETDEWEB)

    Wu, Xing-Gang [Chongqing Univ. (China); Brodsky, Stanley J. [SLAC National Accelerator Lab., Menlo Park, CA (United States); Mojaza, Matin [SLAC National Accelerator Lab., Menlo Park, CA (United States); Univ. of Southern Denmark, Odense (Denmark)

    2013-09-01

    A key problem in making precise perturbative QCD predictions is to set the proper renormalization scale of the running coupling. The conventional scale-setting procedure assigns an arbitrary range and an arbitrary systematic error to fixed-order pQCD predictions. In fact, this ad hoc procedure gives results which depend on the choice of the renormalization scheme, and it is in conflict with the standard scale-setting procedure used in QED. Predictions for physical results should be independent of the choice of the scheme or other theoretical conventions. We review current ideas and points of view on how to deal with the renormalization scale ambiguity and show how to obtain renormalization scheme- and scale-independent estimates. We begin by introducing the renormalization group (RG) equation and an extended version, which expresses the invariance of physical observables under both the renormalization scheme and scale-parameter transformations. The RG equation provides a convenient way for estimating the scheme- and scale-dependence of a physical process. We then discuss self-consistency requirements of the RG equations, such as reflexivity, symmetry, and transitivity, which must be satisfied by a scale-setting method. Four typical scale setting methods suggested in the literature, i.e., the Fastest Apparent Convergence (FAC) criterion, the Principle of Minimum Sensitivity (PMS), the Brodsky–Lepage–Mackenzie method (BLM), and the Principle of Maximum Conformality (PMC), are introduced. Basic properties and their applications are discussed. We pay particular attention to the PMC, which satisfies all of the requirements of RG invariance. Using the PMC, all non-conformal terms associated with the β-function in the perturbative series are summed into the running coupling, and one obtains a unique, scale-fixed, scheme-independent prediction at any finite order. The PMC provides the principle underlying the BLM method, since it gives the general rule for extending

  20. Deriving Accurate Interproton Distances from ROESY Spectra with Limited Knowledge of Scalar Coupling Constants via the CARNIVAL Algorithm. An Iterative Complete-Relaxation-Matrix Approach

    Science.gov (United States)

    Liu, H.; Banville, D. L.; Basus, V. J.; James, T. L.

    A method (termed CARNIVAL) for accurately determining distances from proton homonuclear rotating-frame Overhauser effect spectroscopy (ROESY) is described. The method entails an iterative calculation of the relaxation matrix using methodology introduced with the MARDIGRAS algorithm for analysis of two-dimensional nuclear Overhauser effect spectra (B. A. Borgias and T. L. James, J. Magn. Reson.87, 475, 1990). The situation is complicated in the case of ROESY as spectral peak intensities are influenced by resonance offset and contributions from homonuclear Hartmann-Hahn (HOHAHA) transfer if the nuclear spins are related by scalar coupling. The effects of spin-locking field strength on distance determinations and the ensuing distance errors incurred when HOHAHA corrections are made with limited knowledge of scalar ( J) coupling information have been evaluated using simulated ROESY intensities with a model peptide structure. It has been demonstrated that accurate distances can be obtained with little or no explicit knowledge of the homonuclear coupling constants over a moderate range of spin-locking field strengths. The CARNIVAL algorithm has been utilized to determine distances in a decapeptide using experimental ROESY data without measured coupling constants.

  1. Determination of long-range scalar 1H-1H coupling constants responsible for polarization transfer in SABRE

    Science.gov (United States)

    Eshuis, Nan; Aspers, Ruud L. E. G.; van Weerdenburg, Bram J. A.; Feiters, Martin C.; Rutjes, Floris P. J. T.; Wijmenga, Sybren S.; Tessari, Marco

    2016-04-01

    SABRE (Signal Amplification By Reversible Exchange) nuclear spin hyperpolarization method can provide strongly enhanced NMR signals as a result of the reversible association of small molecules with para-hydrogen (p-H2) at an iridium metal complex. The conversion of p-H2 singlet order to enhanced substrate proton magnetization within such complex is driven by the scalar coupling interactions between the p-H2 derived hydrides and substrate nuclear spins. In the present study these long-range homonuclear couplings are experimentally determined for several SABRE substrates using an NMR pulse sequence for coherent hyperpolarization transfer at high magnetic field. Pyridine and pyrazine derivatives appear to have a similar ∼1.2 Hz 4J coupling to p-H2 derived hydrides for their ortho protons, and a much lower 5J coupling for their meta protons. Interestingly, the 4J hydride-substrate coupling for five-membered N-heterocyclic substrates is well below 1 Hz.

  2. Strong-Coupling Properties of a p-Wave Interacting Fermi Gas on the Viewpoint of Specific Heat at Constant Volume

    Science.gov (United States)

    Inotani, Daisuke; van Wyk, Pieter; Ohashi, Yoji

    2017-02-01

    We theoretically investigate the specific heat CV at constant volume in the normal state of a p-wave interacting Fermi gas. Including fluctuations in the p-wave Cooper channel within the framework of the strong-coupling theory developed by Nozières and Schmitt-Rink, we clarify how CV as a function of temperature varies, as one moves from the weak-coupling regime to the strong-coupling limit. In the weak-coupling regime, CV is shown to be enhanced by p-wave pairing fluctuations, near the superfluid phase transition temperature Tc. Similar enhancement of CV(T ≃ Tc) is also obtained in the strong-coupling regime, which, however, reflects that system is close an ideal Bose gas of p-wave two-body bound molecules. Using these results, we classify the normal state into (1) the normal Fermi gas regime, (2) the p-wave molecular Bose gas regime, and (3) the region between the two, where p-wave pairing fluctuations are dominant. Since the current experiments can only access the normal phase of a p-wave interacting Fermi gas, our results would be useful for experiments to understand strong-coupling properties of this Fermi system above Tc.

  3. Local renormalization method for random systems

    OpenAIRE

    Gittsovich O.; Hubener R.; Rico E.; Briegel H.J.

    2010-01-01

    In this paper, we introduce a real-space renormalization transformation for random spin systems on 2D lattices. The general method is formulated for random systems and results from merging two well known real space renormalization techniques, namely the strong disorder renormalization technique (SDRT) and the contractor renormalization (CORE). We analyze the performance of the method on the 2D random transverse field Ising model (RTFIM).

  4. Heat Kernel Renormalization on Manifolds with Boundary

    OpenAIRE

    Albert, Benjamin I.

    2016-01-01

    In the monograph Renormalization and Effective Field Theory, Costello gave an inductive position space renormalization procedure for constructing an effective field theory that is based on heat kernel regularization of the propagator. In this paper, we extend Costello's renormalization procedure to a class of manifolds with boundary. In addition, we reorganize the presentation of the preexisting material, filling in details and strengthening the results.

  5. Renormalization of QED with planar binary trees

    OpenAIRE

    Brouder, Christian; Frabetti, Alessandra

    2000-01-01

    The renormalized photon and electron propagators are expanded over planar binary trees. Explicit recurrence solutions are given for the terms of these expansions. In the case of massless Quantum Electrodynamics (QED), the relation between renormalized and bare expansions is given in terms of a Hopf algebra structure. For massive quenched QED, the relation between renormalized and bare expansions is given explicitly.

  6. Ghost wavefunction renormalization in asymptotically safe quantum gravity

    Energy Technology Data Exchange (ETDEWEB)

    Groh, Kai; Saueressig, Frank, E-mail: kgroh@thep.physik.uni-mainz.d, E-mail: saueressig@thep.physik.uni-mainz.d [Institute of Physics, University of Mainz, Staudingerweg 7, D-55099 Mainz (Germany)

    2010-09-10

    Motivated by Weinberg's asymptotic safety scenario, we investigate the gravitational renormalization group flow in the Einstein-Hilbert truncation supplemented by the wavefunction renormalization of the ghost fields. The latter induces non-trivial corrections to the {beta}-functions for Newton's constant and the cosmological constant. The resulting ghost-improved phase diagram is investigated in detail. In particular, we find a non-trivial ultraviolet fixed point, in agreement with the asymptotic safety conjecture which also survives in the presence of extra dimensions. In four dimensions the ghost anomalous dimension at the fixed point is {eta}*{sub c} = -1.8, supporting spacetime being effectively two dimensional at short distances.

  7. Solar System constraints on massless scalar-tensor gravity with positive coupling constant upon cosmological evolution of the scalar field

    Science.gov (United States)

    Anderson, David; Yunes, Nicolás

    2017-09-01

    Scalar-tensor theories of gravity modify general relativity by introducing a scalar field that couples nonminimally to the metric tensor, while satisfying the weak-equivalence principle. These theories are interesting because they have the potential to simultaneously suppress modifications to Einstein's theory on Solar System scales, while introducing large deviations in the strong field of neutron stars. Scalar-tensor theories can be classified through the choice of conformal factor, a scalar that regulates the coupling between matter and the metric in the Einstein frame. The class defined by a Gaussian conformal factor with a negative exponent has been studied the most because it leads to spontaneous scalarization (i.e. the sudden activation of the scalar field in neutron stars), which consequently leads to large deviations from general relativity in the strong field. This class, however, has recently been shown to be in conflict with Solar System observations when accounting for the cosmological evolution of the scalar field. We here study whether this remains the case when the exponent of the conformal factor is positive, as well as in another class of theories defined by a hyperbolic conformal factor. We find that in both of these scalar-tensor theories, Solar System tests are passed only in a very small subset of coupling parameter space, for a large set of initial conditions compatible with big bang nucleosynthesis. However, while we find that it is possible for neutron stars to scalarize, one must carefully select the coupling parameter to do so, and even then, the scalar charge is typically 2 orders of magnitude smaller than in the negative-exponent case. Our study suggests that future work on scalar-tensor gravity, for example in the context of tests of general relativity with gravitational waves from neutron star binaries, should be carried out within the positive coupling parameter class.

  8. Renormalization of QED near Decoupling Temperature

    CERN Document Server

    Masood, Samina S

    2014-01-01

    We study the effective parameters of QED near decoupling temperatures and show that the QED perturbative series is convergent, at temperatures below the decoupling temperature. The renormalization constant of QED acquires different values if a system cools down from a hotter system to the electron mass temperature or heats up from a cooler system to the same temperature. At T = m, the first order contribution to the electron selfmass, {\\delta}m/m is 0.0076 for a heating system and 0.0115 for a cooling system and the difference between two values is equal to 1/3 of the low temperature value and 1/2 of the high temperature value around T~m. This difference is a measure of hot fermion background at high temperatures. With the increase in release of more fermions at hotter temperatures, the fermion background contribution dominates and weak interactions have to be incorporated to understand the background effects.

  9. Charge renormalization in nominally apolar colloidal dispersions.

    Science.gov (United States)

    Evans, Daniel J; Hollingsworth, Andrew D; Grier, David G

    2016-04-01

    We present high-resolution measurements of the pair interactions between dielectric spheres dispersed in a fluid medium with a low dielectric constant. Despite the absence of charge control agents or added organic salts, these measurements reveal strong and long-ranged repulsions consistent with substantial charges on the particles whose interactions are screened by trace concentrations of mobile ions in solution. The dependence of the estimated charge on the particles' radii is consistent with charge renormalization theory and, thus, offers insights into the charging mechanism in this interesting class of model systems. The measurement technique, based on optical-tweezer manipulation and artifact-free particle tracking, makes use of optimal statistical methods to reduce measurement errors to the femtonewton frontier while covering an extremely wide range of interaction energies.

  10. VLES Modelling with the Renormalization Group

    Institute of Scientific and Technical Information of China (English)

    Chris De Langhe; Bart Merci; Koen Lodefier; Erik Dick

    2003-01-01

    In a Very-Large-Eddy Simulation (VLES), the filterwidth-wavenumber can be outside the inertial range, and simple subgrid models have to be replaced by more complicated ('RANS-like') models which can describe the transport of the biggest eddies. One could approach this by using a RANS model in these regions, and modify the lengthscale in the model for the LES-regions[1~3]. The problem with these approaches is that these models are specifically calibrated for RANS computations, and therefore not suitable to describe inertial range quantities. We investigated the construction of subgrid viscosity and transport equations without any calibrated constants, but these are calculated directly form the Navier-Stokes equation by means of a Renormalization Group (RG)procedure. This leads to filterwidth dependent transport equations and effective viscosity with the right limiting behaviour (DNS and RANS limits).

  11. A Comment on the Renormalization of the Nonlinear Sigma Model

    CERN Document Server

    Bettinelli, D; Quadri, A; Bettinelli, Daniele; Ferrari, Ruggero; Quadri, Andrea

    2007-01-01

    We consider the recently proposed renormalization procedure for the nonlinear sigma model, consisting in the recursive subtraction of the divergences in a symmetric fashion. We compare this subtraction with the conventional procedure in power counting renormalizable (PCR) theories. We argue that symmetric subtraction in the nonlinear sigma model does not follow the lore by which nonrenormalizable theories require an infinite number of parameter fixings. Our conclusion is that only two parameters can be consistently used as physical constants.

  12. Renormalization of oscillator lattices with disorder.

    Science.gov (United States)

    Ostborn, Per

    2009-05-01

    A real-space renormalization transformation is constructed for lattices of nonidentical oscillators with dynamics of the general form dvarphi_{k}/dt=omega_{k}+g summation operator_{l}f_{lk}(varphi_{l},varphi_{k}) . The transformation acts on ensembles of such lattices. Critical properties corresponding to a second-order phase transition toward macroscopic synchronization are deduced. The analysis is potentially exact but relies in part on unproven assumptions. Numerically, second-order phase transitions with the predicted properties are observed as g increases in two structurally different two-dimensional oscillator models. One model has smooth coupling f_{lk}(varphi_{l},varphi_{k})=phi(varphi_{l}-varphi_{k}) , where phi(x) is nonodd. The other model is pulse coupled, with f_{lk}(varphi_{l},varphi_{k})=delta(varphi_{l})phi(varphi_{k}) . Lower bounds for the critical dimensions for different types of coupling are obtained. For nonodd coupling, macroscopic synchronization cannot be ruled out for any dimension D> or =1 , whereas in the case of odd coupling, the well-known result that it can be ruled out for D<3 is regained.

  13. Minimalist Relativistic Force Field: Prediction of Proton-Proton Coupling Constants in (1)H NMR Spectra Is Perfected with NBO Hybridization Parameters.

    Science.gov (United States)

    Kutateladze, Andrei G; Mukhina, Olga A

    2015-05-15

    We previously developed a reliable method for multiparametric scaling of Fermi contacts to achieve fast and accurate prediction of proton-proton spin-spin coupling constants (SSCC) in (1)H NMR. We now report that utilization of NBO hybridization coefficients for carbon atoms in the involved C-H bonds allows for a significant simplification of this parametric scheme, requiring only four general types of SSCCs: geminal, vicinal, 1,3-, and long-range constants. The method is optimized for inexpensive B3LYP/6-31G(d) molecular geometries. A new DU8 basis set, based on a training set of 475 experimental spin-spin coupling constants, is developed for hydrogen and common non-hydrogen atoms (Li, B, C, N, O, F, Si, P, S, Cl, Se, Br, I) to calculate Fermi contacts. On a test set of 919 SSCCs from a diverse collection of natural products and complex synthetic molecules the method gave excellent accuracy of 0.29 Hz (rmsd) with the maximum unsigned error not exceeding 1 Hz.

  14. A Systematic All-Orders Method to Eliminate Renormalization-Scale and Scheme Ambiguities in PQCD

    CERN Document Server

    Mojaza, Matin; Wu, Xing-Gang

    2012-01-01

    We introduce a generalization of the conventional renormalization schemes used in dimensional regularization, which illuminates the renormalization scheme and scale ambiguities of pQCD predictions, exposes the general pattern of nonconformal {\\beta_i}-terms, and reveals a special degeneracy of the terms in the perturbative coefficients. It allows us to systematically determine the argument of the running coupling order by order in pQCD in a form which can be readily automatized. The new method satisfies all of the principles of the renormalization group and eliminates an unnecessary source of systematic error.

  15. Systematic all-orders method to eliminate renormalization-scale and scheme ambiguities in perturbative QCD.

    Science.gov (United States)

    Mojaza, Matin; Brodsky, Stanley J; Wu, Xing-Gang

    2013-05-10

    We introduce a generalization of the conventional renormalization schemes used in dimensional regularization, which illuminates the renormalization scheme and scale ambiguities of perturbative QCD predictions, exposes the general pattern of nonconformal {β(i)} terms, and reveals a special degeneracy of the terms in the perturbative coefficients. It allows us to systematically determine the argument of the running coupling order by order in perturbative QCD in a form which can be readily automatized. The new method satisfies all of the principles of the renormalization group and eliminates an unnecessary source of systematic error.

  16. Lecture Notes on Holographic Renormalization

    CERN Document Server

    Skenderis, K

    2002-01-01

    We review the formalism of holographic renormalization. We start by discussing mathematical results on asymptotically anti-de Sitter spacetimes. We then outline the general method of holographic renormalization. The method is illustrated by working all details in a simple example: a massive scalar field on anti-de Sitter spacetime. The discussion includes the derivation of the on-shell renormalized action, of holographic Ward identities, anomalies and RG equations, and the computation of renormalized one-, two- and four-point functions. We then discuss the application of the method to holographic RG flows. We also show that the results of the near-boundary analysis of asymptotically AdS spacetimes can be analytically continued to apply to asymptotically de Sitter spacetimes. In particular, it is shown that the Brown-York stress energy tensor of de Sitter spacetime is equal, up to a dimension dependent sign, to the Brown-York stress energy tensor of an associated AdS spacetime.

  17. Simple perturbative renormalization scheme for supersymmetric gauge theories

    Energy Technology Data Exchange (ETDEWEB)

    Foda, O.E. (Purdue Univ., Lafayette, IN (USA). Dept. of Physics)

    1983-06-30

    We show that the manifestly supersymmetric and gauge-invariant results of Supersymmetric Dimensional renormalization (SDR) are reproduceable through a simple, and mathematically consistent perturbative renormalization technique, where regularization is attained via a map that deforms the momentum space Feynman integrands in a specific way. In particular, it introduces a multiplicative factor of ((p+q)/..delta..)/sup -/delta in each momentum-space loop integral, where p is the magnitude of the loop momentum, q is an arbitrary constant to be chosen as will be explained, thus compensating for loss of translation invariance in p, ..lambda.. is a renormalization mass, and delta is a suitable non-integer: the analog of epsilon in dimensional schemes. All Dirac algebra and integration are four-dimensional, and renormalization is achieved by subtracting poles in delta, followed by setting delta->O. The mathematical inconsistencies of SDR are evaded by construction, since the numbers of fermion and boson degrees of freedom remain unchanged but analytic continuation in the number of dimensions is bypassed. Thus, the technique is equally viable in component and in superfield formalisms, and all anomalies are realized. The origin of the chiral anomaly is that no choice of q satisfies both gauge and chiral Ward identities simultaneously.

  18. On the truncation of the number of excited states in density functional theory sum-over-states calculations of indirect spin spin coupling constants

    Energy Technology Data Exchange (ETDEWEB)

    Zarycz, M. Natalia C., E-mail: mnzarycz@gmail.com; Provasi, Patricio F., E-mail: patricio@unne.edu.ar [Department of Physics, University of Northeastern - CONICET, Av. Libertad 5500, Corrientes W3404AAS (Argentina); Sauer, Stephan P. A., E-mail: sauer@kiku.dk [Department of Chemistry, University of Copenhagen, Universitetsparken 5, DK-2100 Copenhagen Ø (Denmark)

    2015-12-28

    It is investigated, whether the number of excited (pseudo)states can be truncated in the sum-over-states expression for indirect spin-spin coupling constants (SSCCs), which is used in the Contributions from Localized Orbitals within the Polarization Propagator Approach and Inner Projections of the Polarization Propagator (IPPP-CLOPPA) approach to analyzing SSCCs in terms of localized orbitals. As a test set we have studied the nine simple compounds, CH{sub 4}, NH{sub 3}, H{sub 2}O, SiH{sub 4}, PH{sub 3}, SH{sub 2}, C{sub 2}H{sub 2}, C{sub 2}H{sub 4}, and C{sub 2}H{sub 6}. The excited (pseudo)states were obtained from time-dependent density functional theory (TD-DFT) calculations with the B3LYP exchange-correlation functional and the specialized core-property basis set, aug-cc-pVTZ-J. We investigated both how the calculated coupling constants depend on the number of (pseudo)states included in the summation and whether the summation can be truncated in a systematic way at a smaller number of states and extrapolated to the total number of (pseudo)states for the given one-electron basis set. We find that this is possible and that for some of the couplings it is sufficient to include only about 30% of the excited (pseudo)states.

  19. On the truncation of the number of excited states in density functional theory sum-over-states calculations of indirect spin spin coupling constants.

    Science.gov (United States)

    Zarycz, M Natalia C; Provasi, Patricio F; Sauer, Stephan P A

    2015-12-28

    It is investigated, whether the number of excited (pseudo)states can be truncated in the sum-over-states expression for indirect spin-spin coupling constants (SSCCs), which is used in the Contributions from Localized Orbitals within the Polarization Propagator Approach and Inner Projections of the Polarization Propagator (IPPP-CLOPPA) approach to analyzing SSCCs in terms of localized orbitals. As a test set we have studied the nine simple compounds, CH4, NH3, H2O, SiH4, PH3, SH2, C2H2, C2H4, and C2H6. The excited (pseudo)states were obtained from time-dependent density functional theory (TD-DFT) calculations with the B3LYP exchange-correlation functional and the specialized core-property basis set, aug-cc-pVTZ-J. We investigated both how the calculated coupling constants depend on the number of (pseudo)states included in the summation and whether the summation can be truncated in a systematic way at a smaller number of states and extrapolated to the total number of (pseudo)states for the given one-electron basis set. We find that this is possible and that for some of the couplings it is sufficient to include only about 30% of the excited (pseudo)states.

  20. Accurate Three States Model for Amino Acids with Two Chemically Coupled Titrating Sites in Explicit Solvent Atomistic Constant pH Simulations and pKa Calculations.

    Science.gov (United States)

    Dobrev, Plamen; Donnini, Serena; Groenhof, Gerrit; Grubmüller, Helmut

    2017-01-10

    Correct protonation of titratable groups in biomolecules is crucial for their accurate description by molecular dynamics simulations. In the context of constant pH simulations, an additional protonation degree of freedom is introduced for each titratable site, allowing the protonation state to change dynamically with changing structure or electrostatics. Here, we extend previous approaches for an accurate description of chemically coupled titrating sites. A second reaction coordinate is used to switch between two tautomeric states of an amino acid with chemically coupled titratable sites, such as aspartate (Asp), glutamate (Glu), and histidine (His). To this aim, we test a scheme involving three protonation states. To facilitate charge neutrality as required for periodic boundary conditions and Particle Mesh Ewald (PME) electrostatics, titration of each respective amino acid is coupled to a "water" molecule that is charged in the opposite direction. Additionally, a force field modification for Amber99sb is introduced and tested for the description of carboxyl group protonation. Our three states model is tested by titration simulations of Asp, Glu, and His, yielding a good agreement, reproducing the correct geometry of the groups in their different protonation forms. We further show that the ion concentration change due to the neutralizing "water" molecules does not significantly affect the protonation free energies of the titratable groups, suggesting that the three states model provides a good description of biomolecular dynamics at constant pH.

  1. Renormalization group invariance and optimal QCD renormalization scale-setting: a key issues review.

    Science.gov (United States)

    Wu, Xing-Gang; Ma, Yang; Wang, Sheng-Quan; Fu, Hai-Bing; Ma, Hong-Hao; Brodsky, Stanley J; Mojaza, Matin

    2015-12-01

    A valid prediction for a physical observable from quantum field theory should be independent of the choice of renormalization scheme--this is the primary requirement of renormalization group invariance (RGI). Satisfying scheme invariance is a challenging problem for perturbative QCD (pQCD), since a truncated perturbation series does not automatically satisfy the requirements of the renormalization group. In a previous review, we provided a general introduction to the various scale setting approaches suggested in the literature. As a step forward, in the present review, we present a discussion in depth of two well-established scale-setting methods based on RGI. One is the 'principle of maximum conformality' (PMC) in which the terms associated with the β-function are absorbed into the scale of the running coupling at each perturbative order; its predictions are scheme and scale independent at every finite order. The other approach is the 'principle of minimum sensitivity' (PMS), which is based on local RGI; the PMS approach determines the optimal renormalization scale by requiring the slope of the approximant of an observable to vanish. In this paper, we present a detailed comparison of the PMC and PMS procedures by analyzing two physical observables R(e+e-) and [Formula: see text] up to four-loop order in pQCD. At the four-loop level, the PMC and PMS predictions for both observables agree within small errors with those of conventional scale setting assuming a physically-motivated scale, and each prediction shows small scale dependences. However, the convergence of the pQCD series at high orders, behaves quite differently: the PMC displays the best pQCD convergence since it eliminates divergent renormalon terms; in contrast, the convergence of the PMS prediction is questionable, often even worse than the conventional prediction based on an arbitrary guess for the renormalization scale. PMC predictions also have the property that any residual dependence on the choice

  2. Homonuclear BIRD-decoupled spectra for measuring one-bond couplings with highest resolution: CLIP/CLAP-RESET and constant-time-CLIP/CLAP-RESET.

    Science.gov (United States)

    Reinsperger, Tony; Luy, Burkhard

    2014-02-01

    Heteronuclear one-bond couplings are of interest for various aspects of structural analysis of small organic molecules, including for example the distinction of axial and equatorial protons or the use of RDCs as angular constraints. Such couplings are most easily measured from pure doublets in HSQC-type spectra. Recently, the fully decoupled RESET HSQC experiment was reported and several other so-called pure-shift methods followed that allow for the removal of splittings due to homonuclear scalar interactions in one and two-dimensional NMR. In this work we present broadband homonuclear decoupled CLIP/CLAP-RESET experiments based on an isotope-selective BIRD filter element using a recently reported improved version of Zangger-Sterk data chunking. The concatenated FIDs result in multiplets in which most homonuclear splittings are removed while the heteronuclear one-bond couplings are retained. Couplings can be extracted in an IPAP fashion without scaling of subspectra by the use of optimized coherence transfer elements like the COB-INEPT. The method leads to complete homonuclear decoupling for CH groups and CH3 groups in isotropic samples, but leaves residual splittings with antiphase contributions for e.g. CH2 groups due to (2)JHH coupling evolution that is not affected by the BIRD element. For this case we present a constant-time version of the proposed BIRD decoupling scheme with full homonuclear decoupling. In addition, the effects of strong coupling are discussed. Strong coupling artifacts cannot be circumvented, but the proposed experiments allow their distinct recognition.

  3. Renormalization Group Therapy

    CERN Document Server

    Tomboulis, E T

    2007-01-01

    We point out a general problem with the procedures commonly used to obtain improved actions from MCRG decimated configurations. Straightforward measurement of the couplings from the decimated configurations, by one of the known methods, can result into actions that do not correctly reproduce the physics on the undecimated lattice. This is because the decimated configurations are generally not representative of the equilibrium configurations of the assumed form of the effective action at the measured couplings. Curing this involves fine-tuning of the chosen MCRG decimation procedure, which is also dependent on the form assumed for the effective action. We illustrate this in decimation studies of the SU(2) LGT using Swendsen and Double Smeared Blocking decimation procedures. A single-plaquette improved action involving five group representations and free of this pathology is given.

  4. Renormalization of the hydrogen sulfide properties due to the strong electron-phonon interaction

    Science.gov (United States)

    Kudryashov, N. A.; Kutukov, A. A.; Mazur, E. A.

    2017-01-01

    The normal state of a metal is described by generalized Eliashberg theory which takes into account the finite width of an electron band, strong electron-phonon coupling and electron-hole nonequivalence. Reconstructed parameters of the conduction band of the metallic hydrogen sulfide for both the real and imaginary parts of the mass renormalization of the electron Green’s function and the real and imaginary parts of the renormalization of the chemical potential have been found.

  5. Prospects and status of quark mass renormalization in three-flavour QCD

    CERN Document Server

    Campos, I; Pena, C; Preti, D; Ramos, A; Vladikas, A

    2015-01-01

    We present the current status of a revised strategy to compute the running of renormalized quark masses in QCD with three flavours of massless O(a) improved Wilson quarks. The strategy employed uses the standard finite-size scaling method in the Schr\\"odinger functional and accommodates for the non-perturbative scheme-switch which becomes necessary at intermediate renormalized couplings as discussed in [arXiv:1411.7648].

  6. Dynamics, NMR parameters and hyperfine coupling constants of the Fe3O4(1 0 0)-water interface: Implications for MRI probes

    Science.gov (United States)

    Gonçalves, Mateus A.; Peixoto, Fernando C.; da Cunha, Elaine F. F.; Ramalho, Teodorico C.

    2014-08-01

    Magnetite is an iron oxide widely used as contrast agent in MRI, receiving considerable interest from nanoscience and nanotechnology. In this work, the face 1 0 0 of the magnetite structure was studied with water in order to obtain 1H hyperfine coupling constants (HFCCs). Molecular dynamics (MD) calculations were performed using the ReaxFF program and for statistical inefficiency, structures were selected for HFCC and NMR calculations. From our theoretical findings, the magnetite in solution considerably increases the 1H HFCC of water molecules. From our results, it is essential to incorporate the dynamics and solvent effects into NMR calculations of relaxation parameters.

  7. Computing the effective action with the functional renormalization group

    DEFF Research Database (Denmark)

    Codello, Alessandro; Percacci, Roberto; Rachwał, Lesław

    2016-01-01

    The “exact” or “functional” renormalization group equation describes the renormalization group flow of the effective average action Γ k. The ordinary effective action Γ 0 can be obtained by integrating the flow equation from an ultraviolet scale k= Λ down to k= 0. We give several examples of such...... of QED and of Yang–Mills theory. We also compute the two-point functions for scalars and gravitons in the effective field theory of scalar fields minimally coupled to gravity.......The “exact” or “functional” renormalization group equation describes the renormalization group flow of the effective average action Γ k. The ordinary effective action Γ 0 can be obtained by integrating the flow equation from an ultraviolet scale k= Λ down to k= 0. We give several examples...... of such calculations at one-loop, both in renormalizable and in effective field theories. We reproduce the four-point scattering amplitude in the case of a real scalar field theory with quartic potential and in the case of the pion chiral Lagrangian. In the case of gauge theories, we reproduce the vacuum polarization...

  8. Renormalization of the Spin-dependent WIMP scattering off nuclei

    CERN Document Server

    Divari, P C

    2013-01-01

    We study the amplitude for the spin-dependent WIMP scattering off nuclei by including the leading long-range two-body currents in the most important isovector contribution. We show that such effects are essentially independent of the target nucleus and, as a result, they can be treated as a mere renormalization of the effective nucleon cross section or, equivalently, of the corresponding effective coupling with values around 25%.

  9. Renormalization and Induced Gauge Action on a Noncommutative Space

    CERN Document Server

    Grosse, Harald

    2007-01-01

    Field theories on deformed spaces suffer from the IR/UV mxing and renormalization is generically spoiled. In work with R. Wulkenhaar, one of us realized a way to cure this desease by adding one more marginal operator. We review these ideas, show the application to $\\phi^3$ models and use heat kernel expansion methods for a scalar field theory coupled to an external gauge field on a $\\theta$-deformed space and derive noncommutative gauge actions.

  10. Scalar meson mass from renormalized One Boson Exchange Potential

    CERN Document Server

    Cordon, A Calle

    2008-01-01

    We determine the mass and strength of the scalar meson from NN scattering data by renormalizing the One Boson Exchange Potential. This procedure provides a great insensitivity to the unknown short distance interaction making the vector mesons marginally important and allowing for SU(3) couplings in the 1S0 channel. The scalar meson parameters are tightly constrained by low energy np. We discuss whether this scalar should be compared to the recent findings based on the Roy equations analysis of pipi scattering.

  11. Renormalization-group calculation of excitation properties for impurity models

    Science.gov (United States)

    Yoshida, M.; Whitaker, M. A.; Oliveira, L. N.

    1990-05-01

    The renormalization-group method developed by Wilson to calculate thermodynamical properties of dilute magnetic alloys is generalized to allow the calculation of dynamical properties of many-body impurity Hamiltonians. As a simple illustration, the impurity spectral density for the resonant-level model (i.e., the U=0 Anderson model) is computed. As a second illustration, for the same model, the longitudinal relaxation rate for a nuclear spin coupled to the impurity is calculated as a function of temperature.

  12. The Renormalization Effects in the Microstrip-SQUID Amplifier

    CERN Document Server

    Berman, G P; Tsifrinovich, V I

    2011-01-01

    The peculiarities of the microstrip-DC SQUID amplifier caused by the resonant structure of the input circuit are analyzed. It is shown that the mutual inductance, that couples the input circuit and the SQUID loop, depends on the frequency of electromagnetic field. The renormalization of the SQUID parameters due to the screening effect of the input circuit vanishes when the Josephson frequency is much greater than the signal frequency.

  13. The calculation of accurate 17O hyperfine coupling constants in the hydroxyl radical: A difficult problem for current quantum chemical methods

    Science.gov (United States)

    Wetmore, Stacey D.; Eriksson, Leif A.; Boyd, Russell J.

    1998-12-01

    The hyperfine coupling constants (HFCCs) in the hydroxyl radical are investigated through comparison of results obtained from a variety of quantum chemical methods. The couplings obtained from the multi-reference configuration interaction (MRCI) wave function, built upon the restricted open-shell Hartree-Fock (ROHF) reference determinant, are investigated in terms of the basis set, the configuration selection energy threshold, and the size of the reference space. Overall results which converge to the experimental couplings are obtained for hydrogen, but not for oxygen. In particular, the MRCI method shows no improvement over density functional theory (the B3LYP functional), for the calculation of Aiso(17O). On the other hand, results in excellent agreement with experiment are obtained through the use of the quadratic configuration interaction (QCISD) method based on the unrestricted HF (UHF) reference determinant with the identical basis sets. Examination of UHF and ROHF based coupled-cluster methods, CCSD and CCSD(T), indicates that once a high enough level of electron correlation is included, the oxygen HFCC is independent of the form of the reference determinant. Unlike the ROHF-CCSD method, which yields reliable results once the effects of triple excitations have been taken into account, the MRCI wave function cannot easily be adjusted to account for the inadequacies of the ROHF reference determinant in order to accurately predict 17O HFCCs.

  14. Pseudoscalar Meson Decay Constants and Couplings, the Witten-Veneziano Formula beyond large N_c, and the Topological Susceptibility

    CERN Document Server

    Shore, G M

    2006-01-01

    The QCD formulae for the radiative decays $\\eta,\\eta'\\to\\c\\c$, and the corresponding Dashen--Gell-Mann--Oakes--Renner relations, differ from conventional PCAC results due to the gluonic $U(1)_A$ axial anomaly. This introduces a critical dependence on the gluon topological susceptibility. In this paper, we revisit our earlier theoretical analysis of radiative pseudoscalar decays and the DGMOR relations and extract explicit experimental values for the decay constants. This is our main result. The flavour singlet DGMOR relation is the generalisation of the Witten-Veneziano formula beyond large $N_c$, so we are able to give a quantitative assessment of the realisation of the $1/N_c$ expansion in the $U(1)_A$ sector of QCD. Applications to other aspects of $\\eta'$ physics, including the relation with the first moment sum rule for the polarised photon structure function $g_1^\\c$, are highlighted. The $U(1)_A$ Goldberger-Treiman relation is extended to accommodate SU(3) flavour breaking and the implications of a mor...

  15. Exact Bremsstrahlung and Effective Couplings

    CERN Document Server

    Mitev, Vladimir

    2015-01-01

    We calculate supersymmetric Wilson loops on the ellipsoid for a large class of $\\mathcal{N}=2$ SCFT using the localization formula of Hama and Hosomichi. From them we extract the radiation emitted by an accelerating heavy probe quark as well as the entanglement entropy following the recent works of Lewkowycz-Maldacena and Fiol-Gerchkovitz-Komargodski. Comparing our results with the $\\mathcal{N}=4$ SYM ones, we obtain interpolating functions $f(g^2)$ such that a given $\\mathcal{N}=2$ SCFT observable is obtained by replacing in the corresponding $\\mathcal{N}=4$ SYM result the coupling constant by $f(g^2)$. These ``exact effective couplings'' encode the finite, relative renormalization between the $\\mathcal{N}=2$ and the $\\mathcal{N}=4$ gluon propagator, they interpolate between the weak and the strong coupling. We discuss the range of their applicability.

  16. Exact Bremsstrahlung and effective couplings

    Science.gov (United States)

    Mitev, Vladimir; Pomoni, Elli

    2016-06-01

    We calculate supersymmetric Wilson loops on the ellipsoid for a large class of mathcal{N} = 2 SCFT using the localization formula of Hama and Hosomichi. From them we extract the radiation emitted by an accelerating heavy probe quark as well as the entanglement entropy following the recent works of Lewkowycz-Maldacena and Fiol-Gerchkovitz-Komargodski. Comparing our results with the mathcal{N} = 4 SYM ones, we obtain interpolating functions f ( g 2) such that a given mathcal{N} = 2 SCFT observable is obtained by replacing in the corresponding mathcal{N} = 4 SYM result the coupling constant by f ( g 2). These "exact effective couplings" encode the finite, relative renormalization between the mathcal{N} = 2 and the mathcal{N} = 4 gluon propagator and they interpolate between the weak and the strong coupling. We discuss the range of their applicability.

  17. Exact Bremsstrahlung and effective couplings

    Energy Technology Data Exchange (ETDEWEB)

    Mitev, Vladimir [Mainz Univ. (Germany). Inst. fuer Physik, WA THEP; Humboldt-Univ. Berlin (Germany). Inst. fuer Mathematik und Inst. fuer Physik; Pomoni, Elli [DESY Hamburg (Germany). Theory Group; National Technical Univ., Athens (Greece). Physics Div.

    2015-11-15

    We calculate supersymmetric Wilson loops on the ellipsoid for a large class of N=2 SCFT using the localization formula of Hama and Hosomichi. From them we extract the radiation emitted by an accelerating heavy probe quark as well as the entanglement entropy following the recent works of Lewkowycz-Maldacena and Fiol-Gerchkovitz-Komargodski. Comparing our results with the N=4 SYM ones, we obtain interpolating functions f(g{sup 2}) such that a given N=2 SCFT observable is obtained by replacing in the corresponding N=4 SYM result the coupling constant by f(g{sup 2}). These ''exact effective couplings'' encode the finite, relative renormalization between the N = 2 and the N = 4 gluon propagator, they interpolate between the weak and the strong coupling. We discuss the range of their applicability.

  18. Non-perturbative renormalization of the quark condensate in Ginsparg-Wilson regularizations

    CERN Document Server

    Hernández, Pilar; Lellouch, L P; Wittig, H; Hernandez, Pilar; Jansen, Karl; Lellouch, Laurent; Wittig, Hartmut

    2001-01-01

    We present a method to compute non-perturbatively the renormalization constant of the scalar density for Ginsparg-Wilson fermions. It relies on chiral symmetry and is based on a matching of renormalization group invariant masses at fixed pseudoscalar meson mass, making use of results previously obtained by the ALPHA Collaboration for O(a)-improved Wilson fermions. Our approach is quite general and enables the renormalization of scalar and pseudoscalar densities in lattice regularizations that preserve chiral symmetry and of fermion masses in any regularization. As an application we compute the non-perturbative factor which relates the renormalization group invariant quark condensate to its bare counterpart, obtained with overlap fermions at beta=5.85 in the quenched approximation.

  19. Analytical continuation in coupling constant method; application to the calculation of resonance energies and widths for organic molecules: Glycine, alanine and valine and dimer of formic acid

    Energy Technology Data Exchange (ETDEWEB)

    Papp, P., E-mail: papp@fmph.uniba.sk [Department of Experimental Physics, Faculty of Mathematics, Physics and Informatics, Comenius University, Mlynská dolina, 84248 Bratislava (Slovakia); Matejčík, Š. [Department of Experimental Physics, Faculty of Mathematics, Physics and Informatics, Comenius University, Mlynská dolina, 84248 Bratislava (Slovakia); Mach, P.; Urban, J. [Department of Nuclear Physics and Biophysics, Faculty of Mathematics, Physics and Informatics, Comenius University, Mlynská dolina, 84248 Bratislava (Slovakia); Paidarová, I. [J. Heyrovský Institute of Physical Chemistry, Academy of Sciences of the Czech Republic, v.v.i., Dolejškova 3, CZ-182 23 Praha 8 (Czech Republic); Horáček, J., E-mail: horacek@mbox.troja.mff.cuni.cz [Charles University, Faculty of Mathematics and Physics, V Holešovičkách 2, CZ-180 00 Praha 8 (Czech Republic)

    2013-06-03

    Highlights: • The anions are stabilized by additional charges on the nuclei. • The energy dependence of anions and neutrals on nuclear charges are calculated by ab initio methods. • Resonance energies and widths are obtained from the energy data by analytical continuation with Padé approximation. • The resonance energies and widths of amino acids are compared with Nestmann–Peyerimhoff’s method and with experiment. • The resonance energies and (widths) of formic acid monomer and dimer are 2.09 (0.33) eV and 1.7 (0.13) eV, respectively. - Abstract: The method of analytic continuation in the coupling constant (ACCC) in combination with use of the statistical Padé approximation is applied to the determination of resonance energy and width of some amino acids and formic acid dimer. Standard quantum chemistry codes provide accurate data which can be used for analytic continuation in the coupling constant to obtain the resonance energy and width of organic molecules with a good accuracy. The obtained results are compared with the existing experimental ones.

  20. Magnetic Coupling Constants in Three Electrons Three Centers Problems from Effective Hamiltonian Theory and Validation of Broken Symmetry-Based Approaches.

    Science.gov (United States)

    Reta, Daniel; Moreira, Ibério de P R; Illas, Francesc

    2016-07-12

    In the most general case of three electrons in three symmetry unrelated centers with Ŝ1 = Ŝ2 = Ŝ3 = 1/2 localized magnetic moments, the low energy spectrum consists of one quartet (Q) and two doublet (D1, D2) pure spin states. The energy splitting between these spin states can be described with the well-known Heisenberg-Dirac-Van Vleck (HDVV) model spin Hamiltonian, and their corresponding energy expressions are expressed in terms of the three different two-body magnetic coupling constants J12, J23, and J13. However, the values of all three magnetic coupling constants cannot be extracted using the calculated energy of the three spin-adapted states since only two linearly independent energy differences between pure spin states exist. This problem has been recently investigated by Reta et al. (J. Chem. Theory Comput. 2015, 11, 3650), resulting in an alternative proposal to the original Noodleman's broken symmetry mapping approach. In the present work, this proposal is validated by means of ab initio effective Hamiltonian theory, which allows a direct extraction of all three J values from the one-to-one correspondence between the matrix elements of both effective and HDVV Hamiltonian. The effective Hamiltonian matrix representation has been constructed from configuration interaction wave functions for the three spin states obtained for two model systems showing a different degree of delocalization of the unpaired electrons. These encompass a trinuclear Cu(II) complex and a π-conjugated purely organic triradical.

  1. Algebraic Lattices in QFT Renormalization

    Science.gov (United States)

    Borinsky, Michael

    2016-07-01

    The structure of overlapping subdivergences, which appear in the perturbative expansions of quantum field theory, is analyzed using algebraic lattice theory. It is shown that for specific QFTs the sets of subdivergences of Feynman diagrams form algebraic lattices. This class of QFTs includes the standard model. In kinematic renormalization schemes, in which tadpole diagrams vanish, these lattices are semimodular. This implies that the Hopf algebra of Feynman diagrams is graded by the coradical degree or equivalently that every maximal forest has the same length in the scope of BPHZ renormalization. As an application of this framework, a formula for the counter terms in zero-dimensional QFT is given together with some examples of the enumeration of primitive or skeleton diagrams.

  2. Holographic Renormalization in Dense Medium

    Directory of Open Access Journals (Sweden)

    Chanyong Park

    2014-01-01

    describes a dense medium at finite temperature, is investigated in this paper. In a dense medium, two different thermodynamic descriptions are possible due to an additional conserved charge. These two different thermodynamic ensembles are classified by the asymptotic boundary condition of the bulk gauge field. It is also shown that in the holographic renormalization regularity of all bulk fields can reproduce consistent thermodynamic quantities and that the Bekenstein-Hawking entropy is nothing but the renormalized thermal entropy of the dual field theory. Furthermore, we find that the Reissner-Nordström AdS black brane is dual to a theory with conformal matter as expected, whereas a charged black brane with a nontrivial dilaton profile is mapped to a theory with nonconformal matter although its leading asymptotic geometry still remains as AdS space.

  3. Vibrational Density Matrix Renormalization Group.

    Science.gov (United States)

    Baiardi, Alberto; Stein, Christopher J; Barone, Vincenzo; Reiher, Markus

    2017-08-08

    Variational approaches for the calculation of vibrational wave functions and energies are a natural route to obtain highly accurate results with controllable errors. Here, we demonstrate how the density matrix renormalization group (DMRG) can be exploited to optimize vibrational wave functions (vDMRG) expressed as matrix product states. We study the convergence of these calculations with respect to the size of the local basis of each mode, the number of renormalized block states, and the number of DMRG sweeps required. We demonstrate the high accuracy achieved by vDMRG for small molecules that were intensively studied in the literature. We then proceed to show that the complete fingerprint region of the sarcosyn-glycin dipeptide can be calculated with vDMRG.

  4. The role of the magnetic orbitals in the calculation of the magnetic coupling constants from multireference perturbation theory methods.

    Science.gov (United States)

    Angeli, Celestino; Calzado, Carmen J

    2012-07-21

    The use of multireference perturbation theory (MRPT) for the calculation of the magnetic coupling in binuclear complexes has shown to give poor results if applied on a minimal active space complete active space self-consistent field (CASSCF) wavefunction. In this work, we identify the origin of this problem in the starting CASSCF orbitals, which are exceedingly localized on the metal atoms. Focusing on the case of antiferromagnetic systems, it is shown that the form of the active orbitals has a dramatic effect on the relative description of the neutral and ionic structures. Finally, a simple and computational inexpensive strategy is proposed for the calculation of a set of magnetic orbitals describing in a more balanced way the neutral and ionic structures. The use of these orbitals, instead the CASSCF ones, in minimal active space MRPT2 calculations leads to a marked improvement of the J values, which become in reasonable agreement with those obtained with the expensive high level difference dedicated configuration interaction approach and with the experimental values.

  5. Concepts of renormalization in physics.

    Science.gov (United States)

    Alexandre, Jean

    2005-01-01

    A non technical introduction to the concept of renormalization is given, with an emphasis on the energy scale dependence in the description of a physical system. We first describe the idea of scale dependence in the study of a ferromagnetic phase transition, and then show how similar ideas appear in particle physics. This short review is written for non-particle physicists and/or students aiming at studying particle physics.

  6. Renormalization group flows and anomalies

    CERN Document Server

    Komargodski, Zohar

    2015-01-01

    This chapter reviews various aspects of renormalization group flows and anomalies. The chapter considers specific Euclidean two-dimensional theories. Namely, the theories are invariant under translations and rotations in the two space directions. Here the chapter studies theories where, if possible, certain equations hold in fact also at coincident points. In other words, the chapter looks at theories where there is no local gravitational anomaly.

  7. Renormalization of Dirac's Polarized Vacuum

    CERN Document Server

    Lewin, Mathieu

    2010-01-01

    We review recent results on a mean-field model for relativistic electrons in atoms and molecules, which allows to describe at the same time the self-consistent behavior of the polarized Dirac sea. We quickly derive this model from Quantum Electrodynamics and state the existence of solutions, imposing an ultraviolet cut-off $\\Lambda$. We then discuss the limit $\\Lambda\\to\\infty$ in detail, by resorting to charge renormalization.

  8. Two-loop RGE of a general renormalizable Yang-Mills theory in a renormalization scheme with an explicit UV cutoff

    CERN Document Server

    Chankowski, Piotr H; Meissner, Krzysztof A

    2016-01-01

    We perform a systematic one-loop renormalization of a general renormalizable Yang-Mills theory coupled to scalars and fermions using a regularization scheme with an explicit UV momentum cutoff $\\Lambda$. We construct the necessary finite counterterms restoring the BRST invariance of the effective action by analyzing the relevant Slavnov-Taylor identities. We find the relation between the renormalized parameters in our scheme and in the conventional $\\overline{\\rm MS}$ scheme which allow us to obtain the explicit two-loop renormalization group equations in our scheme from the known two-loop ones in the $\\overline{\\rm MS}$ scheme. We calculate in our scheme the divergences of two-loop vacuum graphs in the presence of a constant scalar background field which allow us to rederive the two-loop beta functions for parameters of the scalar potential. We also prove that consistent application of the proposed regularization leads to counterterms which, together with the original action, combine to a bare action express...

  9. Two-loop RGE of a general renormalizable Yang-Mills theory in a renormalization scheme with an explicit UV cutoff

    Energy Technology Data Exchange (ETDEWEB)

    Chankowski, Piotr H. [Institute of Theoretical Physics, Faculty of Physics, University of Warsaw,Pasteura 5, 02-093 Warsaw (Poland); Lewandowski, Adrian [Max-Planck-Institut für Gravitationsphysik (Albert-Einstein-Institut),Mühlenberg 1, D-14476 Potsdam (Germany); Institute of Theoretical Physics, Faculty of Physics, University of Warsaw,Pasteura 5, 02-093 Warsaw (Poland); Meissner, Krzysztof A. [Institute of Theoretical Physics, Faculty of Physics, University of Warsaw,Pasteura 5, 02-093 Warsaw (Poland)

    2016-11-18

    We perform a systematic one-loop renormalization of a general renormalizable Yang-Mills theory coupled to scalars and fermions using a regularization scheme with a smooth momentum cutoff Λ (implemented through an exponential damping factor). We construct the necessary finite counterterms restoring the BRST invariance of the effective action by analyzing the relevant Slavnov-Taylor identities. We find the relation between the renormalized parameters in our scheme and in the conventional (MS)-bar scheme which allow us to obtain the explicit two-loop renormalization group equations in our scheme from the known two-loop ones in the (MS)-bar scheme. We calculate in our scheme the divergences of two-loop vacuum graphs in the presence of a constant scalar background field which allow us to rederive the two-loop beta functions for parameters of the scalar potential. We also prove that consistent application of the proposed regularization leads to counterterms which, together with the original action, combine to a bare action expressed in terms of bare parameters. This, together with treating Λ as an intrinsic scale of a hypothetical underlying finite theory of all interactions, offers a possibility of an unconventional solution to the hierarchy problem if no intermediate scales between the electroweak scale and the Planck scale exist.

  10. Two-loop RGE of a general renormalizable Yang-Mills theory in a renormalization scheme with an explicit UV cutoff

    Science.gov (United States)

    Chankowski, Piotr H.; Lewandowski, Adrian; Meissner, Krzysztof A.

    2016-11-01

    We perform a systematic one-loop renormalization of a general renormalizable Yang-Mills theory coupled to scalars and fermions using a regularization scheme with a smooth momentum cutoff Λ (implemented through an exponential damping factor). We construct the necessary finite counterterms restoring the BRST invariance of the effective action by analyzing the relevant Slavnov-Taylor identities. We find the relation between the renormalized parameters in our scheme and in the conventional overline{MS} scheme which allow us to obtain the explicit two-loop renormalization group equations in our scheme from the known two-loop ones in the overline{MS} scheme. We calculate in our scheme the divergences of two-loop vacuum graphs in the presence of a constant scalar background field which allow us to rederive the two-loop beta functions for parameters of the scalar potential. We also prove that consistent application of the proposed regularization leads to counterterms which, together with the original action, combine to a bare action expressed in terms of bare parameters. This, together with treating Λ as an intrinsic scale of a hypothetical underlying finite theory of all interactions, offers a possibility of an unconventional solution to the hierarchy problem if no intermediate scales between the electroweak scale and the Planck scale exist.

  11. Renormalization group approach to superfluid neutron matter

    Energy Technology Data Exchange (ETDEWEB)

    Hebeler, K.

    2007-06-06

    In the present thesis superfluid many-fermion systems are investigated in the framework of the Renormalization Group (RG). Starting from an experimentally determined two-body interaction this scheme provides a microscopic approach to strongly correlated many-body systems at low temperatures. The fundamental objects under investigation are the two-point and the four-point vertex functions. We show that explicit results for simple separable interactions on BCS-level can be reproduced in the RG framework to high accuracy. Furthermore the RG approach can immediately be applied to general realistic interaction models. In particular, we show how the complexity of the many-body problem can be reduced systematically by combining different RG schemes. Apart from technical convenience the RG framework has conceptual advantage that correlations beyond the BCS level can be incorporated in the flow equations in a systematic way. In this case however the flow equations are no more explicit equations like at BCS level but instead a coupled set of implicit equations. We show on the basis of explicit calculations for the single-channel case the efficacy of an iterative approach to this system. The generalization of this strategy provides a promising strategy for a non-perturbative treatment of the coupled channel problem. By the coupling of the flow equations of the two-point and four-point vertex self-consistency on the one-body level is guaranteed at every cutoff scale. (orig.)

  12. On the renormalization of non-commutative field theories

    Science.gov (United States)

    Blaschke, Daniel N.; Garschall, Thomas; Gieres, François; Heindl, Franz; Schweda, Manfred; Wohlgenannt, Michael

    2013-01-01

    This paper addresses three topics concerning the quantization of non-commutative field theories (as defined in terms of the Moyal star product involving a constant tensor describing the non-commutativity of coordinates in Euclidean space). To start with, we discuss the Quantum Action Principle and provide evidence for its validity for non-commutative quantum field theories by showing that the equation of motion considered as insertion in the generating functional Z c [ j] of connected Green functions makes sense (at least at one-loop level). Second, we consider the generalization of the BPHZ renormalization scheme to non-commutative field theories and apply it to the case of a self-interacting real scalar field: Explicit computations are performed at one-loop order and the generalization to higher loops is commented upon. Finally, we discuss the renormalizability of various models for a self-interacting complex scalar field by using the approach of algebraic renormalization.

  13. Material and Doping Dependence of the Nodal and Anti-Nodal Dispersion Renormalizations in Single- and Multi-Layer Cuprates

    Energy Technology Data Exchange (ETDEWEB)

    Johnston, S.; /Waterloo U. /SLAC; Lee, W.S.; /Stanford U., Geballe Lab. /SLAC; Nowadnick, E.A.; /SLAC /Stanford U., Phys. Dept.; Moritz, B.; /SLAC /North Dakota U.; Shen, Z.-X.; /Stanford U., Geballe Lab. /SLAC /Stanford U., Phys. Dept. /Stanford U., Appl. Phys. Dept.; Devereaux, T.P.; /Stanford U., Geballe Lab. /SLAC

    2010-02-15

    In this paper we present a review of bosonic renormalization effects on electronic carriers observed from angle-resolved photoemission spectra in the cuprates. Specifically, we discuss the viewpoint that these renormalizations represent coupling of the electrons to the lattice and review how materials dependence, such as the number of CuO{sub 2} layers, and doping dependence can be understood straightforwardly in terms of several aspects of electron-phonon coupling in layered correlated materials.

  14. Complex networks renormalization: flows and fixed points.

    Science.gov (United States)

    Radicchi, Filippo; Ramasco, José J; Barrat, Alain; Fortunato, Santo

    2008-10-03

    Recently, it has been claimed that some complex networks are self-similar under a convenient renormalization procedure. We present a general method to study renormalization flows in graphs. We find that the behavior of some variables under renormalization, such as the maximum number of connections of a node, obeys simple scaling laws, characterized by critical exponents. This is true for any class of graphs, from random to scale-free networks, from lattices to hierarchical graphs. Therefore, renormalization flows for graphs are similar as in the renormalization of spin systems. An analysis of classic renormalization for percolation and the Ising model on the lattice confirms this analogy. Critical exponents and scaling functions can be used to classify graphs in universality classes, and to uncover similarities between graphs that are inaccessible to a standard analysis.

  15. Renormalization of aperiodic model lattices: spectral properties

    CERN Document Server

    Kroon, L

    2003-01-01

    Many of the published results for one-dimensional deterministic aperiodic systems treat rather simplified electron models with either a constant site energy or a constant hopping integral. Here we present some rigorous results for more realistic mixed tight-binding systems with both the site energies and the hopping integrals having an aperiodic spatial variation. It is shown that the mixed Thue-Morse, period-doubling and Rudin-Shapiro lattices can be transformed to on-site models on renormalized lattices maintaining the individual order between the site energies. The character of the energy spectra for these mixed models is therefore the same as for the corresponding on-site models. Furthermore, since the study of electrons on a lattice governed by the Schroedinger tight-binding equation maps onto the study of elastic vibrations on a harmonic chain, we have proved that the vibrational spectra of aperiodic harmonic chains with distributions of masses determined by the Thue-Morse sequence and the period-doubli...

  16. Quark Confinement and the Renormalization Group

    CERN Document Server

    Ogilvie, Michael C

    2010-01-01

    Recent approaches to quark confinement are reviewed, with an emphasis on their connection to renormalization group methods. Basic concepts related to confinement are introduced: the string tension, Wilson loops and Polyakov lines, string breaking, string tension scaling laws, center symmetry breaking, and the deconfinement transition at non-zero temperature. Current topics discussed include confinement on $R^3\\times S^1$, the real-space renormalization group, the functional renormalization group, and the Schwinger-Dyson equation approach to confinement.

  17. Dressed skeleton expansion and the coupling scale ambiguity problem

    Energy Technology Data Exchange (ETDEWEB)

    Lu, Hung Jung.

    1992-09-01

    Perturbative expansions in quantum field theories are usually expressed in powers of a coupling constant. In principle, the infinite sum of the expansion series is independent of the renormalization scale of the coupling constant. In practice, there is a remnant dependence of the truncated series on the renormalization scale. This scale ambiguity can severely restrict the predictive power of theoretical calculations. The dressed skeleton expansion is developed as a calculational method which avoids the coupling scale ambiguity problem. In this method, physical quantities are expressed as functional expansions in terms of a coupling vertex function. The arguments of the vertex function are given by the physical momenta of each process. These physical momenta effectively replace the unspecified renormalization scale and eliminate the ambiguity problem. This method is applied to various field theoretical models and its main features and limitations are explored. For quantum chromodynamics, an expression for the running coupling constant of the three-gluon vertex is obtained. The effective coupling scale of this vertex is shown to be essentially given by [mu][sup 2] [approximately] Q[sub min][sup 2]Q[sub med][sup 2]/Q[sub max][sup 2] where Q[sub min][sup 2]Q[sub med][sup 2]/Q[sub max][sup 2] are respectively the smallest, the next-to-smallest and the largest scale among the three gluon virtualities. This functional form suggests that the three-gluon vertex becomes non-perturbative at asymmetric momentum configurations. Implications for four-jet physics is discussed.

  18. Dressed skeleton expansion and the coupling scale ambiguity problem

    Energy Technology Data Exchange (ETDEWEB)

    Lu, Hung Jung

    1992-09-01

    Perturbative expansions in quantum field theories are usually expressed in powers of a coupling constant. In principle, the infinite sum of the expansion series is independent of the renormalization scale of the coupling constant. In practice, there is a remnant dependence of the truncated series on the renormalization scale. This scale ambiguity can severely restrict the predictive power of theoretical calculations. The dressed skeleton expansion is developed as a calculational method which avoids the coupling scale ambiguity problem. In this method, physical quantities are expressed as functional expansions in terms of a coupling vertex function. The arguments of the vertex function are given by the physical momenta of each process. These physical momenta effectively replace the unspecified renormalization scale and eliminate the ambiguity problem. This method is applied to various field theoretical models and its main features and limitations are explored. For quantum chromodynamics, an expression for the running coupling constant of the three-gluon vertex is obtained. The effective coupling scale of this vertex is shown to be essentially given by {mu}{sup 2} {approximately} Q{sub min}{sup 2}Q{sub med}{sup 2}/Q{sub max}{sup 2} where Q{sub min}{sup 2}Q{sub med}{sup 2}/Q{sub max}{sup 2} are respectively the smallest, the next-to-smallest and the largest scale among the three gluon virtualities. This functional form suggests that the three-gluon vertex becomes non-perturbative at asymmetric momentum configurations. Implications for four-jet physics is discussed.

  19. Computing the effective action with the functional renormalization group

    Energy Technology Data Exchange (ETDEWEB)

    Codello, Alessandro [CP3-Origins and the Danish IAS University of Southern Denmark, Odense (Denmark); Percacci, Roberto [SISSA, Trieste (Italy); INFN, Sezione di Trieste, Trieste (Italy); Rachwal, Leslaw [Fudan University, Department of Physics, Center for Field Theory and Particle Physics, Shanghai (China); Tonero, Alberto [ICTP-SAIFR and IFT, Sao Paulo (Brazil)

    2016-04-15

    The ''exact'' or ''functional'' renormalization group equation describes the renormalization group flow of the effective average action Γ{sub k}. The ordinary effective action Γ{sub 0} can be obtained by integrating the flow equation from an ultraviolet scale k = Λ down to k = 0. We give several examples of such calculations at one-loop, both in renormalizable and in effective field theories. We reproduce the four-point scattering amplitude in the case of a real scalar field theory with quartic potential and in the case of the pion chiral Lagrangian. In the case of gauge theories, we reproduce the vacuum polarization of QED and of Yang-Mills theory. We also compute the two-point functions for scalars and gravitons in the effective field theory of scalar fields minimally coupled to gravity. (orig.)

  20. Topologically twisted renormalization group flow and its holographic dual

    Science.gov (United States)

    Nakayama, Yu

    2017-03-01

    Euclidean field theories admit more general deformations than usually discussed in quantum field theories because of mixing between rotational symmetry and internal symmetry (also known as topological twist). Such deformations may be relevant, and if the subsequent renormalization group flow leads to a nontrivial fixed point, it generically gives rise to a scale invariant Euclidean field theory without conformal invariance. Motivated by an ansatz studied in cosmological models some time ago, we develop a holographic dual description of such renormalization group flows in the context of AdS /CFT . We argue that the nontrivial fixed points require fine-tuning of the bulk theory, in general, but remarkably we find that the O (3 ) Yang-Mills theory coupled with the four-dimensional Einstein gravity in the minimal manner supports such a background with the Euclidean anti-de Sitter metric.

  1. Topologically twisted renormalization group flow and its holographic dual

    CERN Document Server

    Nakayama, Yu

    2016-01-01

    Euclidean field theories admit more general deformations than usually discussed in quantum field theories because of mixing between rotational symmetry and internal symmetry (a.k.a topological twist). Such deformations may be relevant, and if the subsequent renormalization group flow leads to a non-trivial fixed point, it generically gives rise to a scale invariant Euclidean field theory without conformal invariance. Motivated by an ansatz studied in cosmological models some time ago, we develop a holographic dual description of such renormalization group flows in the context of AdS/CFT. We argue that the non-trivial fixed points require fine-tuning of the bulk theory in general, but remarkably we find that the $O(3)$ Yang-Mills theory coupled with the four-dimensional Einstein gravity in the minimal manner supports such a background with the Euclidean AdS metric.

  2. Keldysh functional renormalization group for electronic properties of graphene

    Science.gov (United States)

    Fräßdorf, Christian; Mosig, Johannes E. M.

    2017-03-01

    We construct a nonperturbative nonequilibrium theory for graphene electrons interacting via the instantaneous Coulomb interaction by combining the functional renormalization group method with the nonequilibrium Keldysh formalism. The Coulomb interaction is partially bosonized in the forward scattering channel resulting in a coupled Fermi-Bose theory. Quantum kinetic equations for the Dirac fermions and the Hubbard-Stratonovich boson are derived in Keldysh basis, together with the exact flow equation for the effective action and the hierarchy of one-particle irreducible vertex functions, taking into account a possible nonzero expectation value of the bosonic field. Eventually, the system of equations is solved approximately under thermal equilibrium conditions at finite temperature, providing results for the renormalized Fermi velocity and the static dielectric function, which extends the zero-temperature results of Bauer et al., Phys. Rev. B 92, 121409 (2015), 10.1103/PhysRevB.92.121409.

  3. Determination of the strong coupling constant $\\alpha_s(m_Z)$ from measurements of the total cross section for top-antitop quark production arXiv

    CERN Document Server

    Klijnsma, Thomas; Dissertori, Günther; Salam, Gavin P.

    We present a determination of the strong coupling constant $\\alpha_s(m_Z)$ using inclusive top-quark pair production cross section measurements performed at the LHC and at the Tevatron. Following a procedure first applied by the CMS collaboration, we extract individual values of $\\alpha_s(m_Z)$ from measurements by different experiments at several centre-of-mass energies, using QCD predictions complete in NNLO perturbation theory, supplemented with NNLL approximations to all orders, and suitable sets of parton distribution functions. The determinations are then combined using a likelihood-based approach, where special emphasis is put on a consistent treatment of theoretical uncertainties and of correlations between various sources of systematic uncertainties. Our final combined result is $\\alpha_s(m_Z) = 0.1177^{+0.0034}_{-0.0036}$.

  4. Next-to-next-to-leading order calculation of the strong coupling constant by using moments of event-shape variables

    Indian Academy of Sciences (India)

    Samira Shoeibi Mohsenabadi; Mohammad Ebrahim Zomorrodian

    2013-11-01

    The next-to-next-to-leading order (NNLO) quantum chromodynamics (QCD) correction to the first three moments of the four event-shape variables in electron–positron annihilation, the thrust, heavy jet mass, wide, and total jet broadening, is computed. It is observed that the NNLO correction gives a better agreement between the theory and the experimental data. Also, by using the above observables, the strong coupling constant () is determined and how much its value is affected by the NNLO correction is demonstrated. By combining the results for all variables at different centre-of-mass energies $(M_{Z^{°}})$ = 0.1248 ± 0.0009 $({\\text{exp.}})_{-0.0144}^{+0.0283} ({\\text{theo.}})$ is obtained.

  5. Nuclear quadrupole coupling constants in complexes B...X2: Sternheimer-type properties of free X2 from experimental intramolecular charge shifts

    Science.gov (United States)

    Fowler, P. W.

    In complexes belonging to the series B...X2(X = halogen), the measured nuclear quadrupole coupling constants show a consistent trend: after allowing for zero-point angular oscillation of X2, chi(X) for the inner nucleus is larger in magnitude than in free X2 while for the outer nucleus it is smaller by approximately the same amount. These observations are consistent with supermolecule calculations reported here and with two simple models. The Townes-Dailey model gives the (small) fraction delta of an electron shifted from the inner to the outer atom on formation B...X2. The long-range model of intermolecular forces allows deduction of a Sternheimer-like response property gzz,z of free X2 from the observed variation of delta with B. For Cl2, the value deduced for gzz,z is 65 au, in reasonable agreement with a previous ab initio result of 45.3 au.

  6. Renormalization group methods for the Reynolds stress transport equations

    Science.gov (United States)

    Rubinstein, R.

    1992-01-01

    The Yakhot-Orszag renormalization group is used to analyze the pressure gradient-velocity correlation and return to isotropy terms in the Reynolds stress transport equations. The perturbation series for the relevant correlations, evaluated to lowest order in the epsilon-expansion of the Yakhot-Orszag theory, are infinite series in tensor product powers of the mean velocity gradient and its transpose. Formal lowest order Pade approximations to the sums of these series produce a rapid pressure strain model of the form proposed by Launder, Reece, and Rodi, and a return to isotropy model of the form proposed by Rotta. In both cases, the model constants are computed theoretically. The predicted Reynolds stress ratios in simple shear flows are evaluated and compared with experimental data. The possibility is discussed of deriving higher order nonlinear models by approximating the sums more accurately. The Yakhot-Orszag renormalization group provides a systematic procedure for deriving turbulence models. Typical applications have included theoretical derivation of the universal constants of isotropic turbulence theory, such as the Kolmogorov constant, and derivation of two equation models, again with theoretically computed constants and low Reynolds number forms of the equations. Recent work has applied this formalism to Reynolds stress modeling, previously in the form of a nonlinear eddy viscosity representation of the Reynolds stresses, which can be used to model the simplest normal stress effects. The present work attempts to apply the Yakhot-Orszag formalism to Reynolds stress transport modeling.

  7. The fermion propagator in cosmological spaces with constant deceleration

    Energy Technology Data Exchange (ETDEWEB)

    Koksma, Jurjen F; Prokopec, Tomislav, E-mail: J.F.Koksma@uu.n, E-mail: T.Prokopec@uu.n [Institute for Theoretical Physics (ITP) and Spinoza Institute, Utrecht University, Postbus 80195, 3508 TD Utrecht (Netherlands)

    2009-06-21

    We calculate the fermion propagator in Friedmann-LemaItre-Robertson-Walker (FLRW) spacetimes with constant deceleration q=epsilon-1, epsilon=-H-dot/H{sup 2} for excited states. For fermions whose mass is generated by a scalar field through a Yukawa coupling m = g{sub Y}phi, we assume phi approx H. We first solve the mode functions by splitting the spinor into a direct product of helicity and chirality spinors. We also allow for non-vacuum states. We normalize the spinors using a consistent canonical quantization and by requiring orthogonality of particle and anti-particle spinors. We apply our propagator to calculate the one-loop effective action and renormalize using dimensional regularization. Since the Hubble parameter is now treated dynamically, this paves the way to study the dynamical backreaction of fermions on the background spacetime.

  8. All-order renormalization of propagator matrix for fermionic system with flavor mixing

    Energy Technology Data Exchange (ETDEWEB)

    Kniehl, Bernd A. [California Univ., Santa Barbara, CA (United States). Kavli Inst. for Theoretical Physics

    2013-08-15

    We consider a mixed system of Dirac fermions in a general parity-nonconserving theory and renormalize the propagator matrix to all orders in the pole scheme, in which the squares of the renormalized masses are identified with the complex pole positions and the wave-function renormalization (WFR) matrices are adjusted in compliance with the Lehmann-Symanzik-Zimmermann reduction formalism. We present closed analytic all-order expressions for the renormalization constants in terms of the scalar, pseudoscalar, vector, and pseudovector parts of the unrenormalized self-energy matrix, which is computable from the one-particle-irreducible Feynman diagrams of the flavor transitions. We identify residual degrees of freedom in the WFR matrices and propose an additional renormalization condition to exhaust them. We then explain how our results may be generalized to the case of unstable fermions, in which we encounter the phenomenon of WFR bifurcation. In the special case of a solitary unstable fermion, the all-order-renormalized propagator is presented in a particularly compact form.

  9. All-order renormalization of the propagator matrix for fermionic systems with flavor mixing.

    Science.gov (United States)

    Kniehl, Bernd A

    2014-02-21

    We consider a mixed system of Dirac fermions in a general parity-nonconserving theory and renormalize the propagator matrix to all orders in the pole scheme, in which the squares of the renormalized masses are identified with the complex pole positions and the wave-function renormalization (WFR) matrices are adjusted in compliance with the Lehmann-Symanzik-Zimmermann reduction formalism. We present closed analytic all-order expressions and their expansions through two loops for the renormalization constants in terms of the scalar, pseudoscalar, vector, and pseudovector parts of the unrenormalized self-energy matrix, which is computable from the one-particle-irreducible Feynman diagrams of the flavor transitions. We identify residual degrees of freedom in the WFR matrices and propose an additional renormalization condition to exhaust them. We then explain how our results may be generalized to the case of unstable fermions, in which we encounter the phenomenon of WFR bifurcation. In the special case of a solitary unstable fermion, the all-order-renormalized propagator is presented in a particularly compact form.

  10. Renormalization of Extended QCD$_2$

    CERN Document Server

    Fukaya, Hidenori

    2015-01-01

    Extended QCD (XQCD) proposed by Kaplan [1] is an interesting reformulation of QCD with additional bosonic auxiliary fields. While its partition function is kept exactly the same as that of original QCD, XQCD naturally contains properties of low energy hadronic models. We analyze the renormalization group flow of two-dimensional (X)QCD, which is solvable in the limit of large number of colors Nc, to understand what kind of roles the auxiliary degrees of freedom play and how the hadronic picture emerges in the low energy region.

  11. New perspectives in the PAW/GIPAW approach: J(P-O-Si) coupling constants, antisymmetric parts of shift tensors and NQR predictions.

    Science.gov (United States)

    Bonhomme, Christian; Gervais, Christel; Coelho, Cristina; Pourpoint, Frédérique; Azaïs, Thierry; Bonhomme-Coury, Laure; Babonneau, Florence; Jacob, Guy; Ferrari, Maude; Canet, Daniel; Yates, Jonathan R; Pickard, Chris J; Joyce, Siân A; Mauri, Francesco; Massiot, Dominique

    2010-12-01

    In 2001, Pickard and Mauri implemented the gauge including projected augmented wave (GIPAW) protocol for first-principles calculations of NMR parameters using periodic boundary conditions (chemical shift anisotropy and electric field gradient tensors). In this paper, three potentially interesting perspectives in connection with PAW/GIPAW in solid-state NMR and pure nuclear quadrupole resonance (NQR) are presented: (i) the calculation of J coupling tensors in inorganic solids; (ii) the calculation of the antisymmetric part of chemical shift tensors and (iii) the prediction of (14)N and (35)Cl pure NQR resonances including dynamics. We believe that these topics should open new insights in the combination of GIPAW, NMR/NQR crystallography, temperature effects and dynamics. Points (i), (ii) and (iii) will be illustrated by selected examples: (i) chemical shift tensors and heteronuclear (2)J(P-O-Si) coupling constants in the case of silicophosphates and calcium phosphates [Si(5)O(PO(4))(6), SiP(2)O(7) polymorphs and α-Ca(PO(3))(2)]; (ii) antisymmetric chemical shift tensors in cyclopropene derivatives, C(3)X(4) (X = H, Cl, F) and (iii) (14)N and (35)Cl NQR predictions in the case of RDX (C(3)H(6)N(6)O(6)), β-HMX (C(4)H(8)N(8)O(8)), α-NTO (C(2)H(2)N(4)O(3)) and AlOPCl(6). RDX, β-HMX and α-NTO are explosive compounds.

  12. Renormalization Group and Phase Transitions in Spin, Gauge, and QCD Like Theories

    Energy Technology Data Exchange (ETDEWEB)

    Liu, Yuzhi [Univ. of Iowa, Iowa City, IA (United States)

    2013-08-01

    In this thesis, we study several different renormalization group (RG) methods, including the conventional Wilson renormalization group, Monte Carlo renormalization group (MCRG), exact renormalization group (ERG, or sometimes called functional RG), and tensor renormalization group (TRG).

  13. Renormalization of dimension 6 gluon operators

    Directory of Open Access Journals (Sweden)

    HyungJoo Kim

    2015-09-01

    Full Text Available We identify the independent dimension 6 twist 4 gluon operators and calculate their renormalization in the pure gauge theory. By constructing the renormalization group invariant combinations, we find the scale invariant condensates that can be estimated in nonperturbative calculations and used in QCD sum rules for heavy quark systems in medium.

  14. Improved system identification with Renormalization Group.

    Science.gov (United States)

    Wang, Qing-Guo; Yu, Chao; Zhang, Yong

    2014-09-01

    This paper proposes an improved system identification method with Renormalization Group. Renormalization Group is applied to a fine data set to obtain a coarse data set. The least squares algorithm is performed on the coarse data set. The theoretical analysis under certain conditions shows that the parameter estimation error could be reduced. The proposed method is illustrated with examples.

  15. Renormalization of Lepton Mixing for Majorana Neutrinos

    CERN Document Server

    Broncano, A; Jenkins, E; Jenkins, Elizabeth

    2005-01-01

    We discuss the one-loop electroweak renormalization of the leptonic mixing matrix in the case of Majorana neutrinos, and establish its relationship with the renormalization group evolution of the dimension five operator responsible for the light Majorana neutrino masses. We compare our results in the effective theory with those in the full seesaw theory.

  16. Renormalization of lepton mixing for Majorana neutrinos

    Energy Technology Data Exchange (ETDEWEB)

    Broncano, A. [Departamento de Fisica Teorica, C-XI, and IFT, C-XVI, Facultad de Ciencias, Universidad Autonoma de Madrid, Cantoblanco, 28049 Madrid (Spain)]. E-mail: alicia.broncano@uam.es; Gavela, M.B. [Departamento de Fisica Teorica, C-XI, and IFT, C-XVI, Facultad de Ciencias, Universidad Autonoma de Madrid, Cantoblanco, 28049 Madrid (Spain)]. E-mail: gavela@delta.ft.uam.es; Jenkins, Elizabeth [Department of Physics, University of California at San Diego, 9500 Gilman Drive, La Jolla, CA 92093 (United States)]. E-mail: ejenkins@ucsd.edu

    2005-01-17

    We discuss the one-loop electroweak renormalization of the leptonic mixing matrix in the case of Majorana neutrinos, and establish its relationship with the renormalization group evolution of the dimension five operator responsible for the light Majorana neutrino masses. We compare our results in the effective theory with those in the full seesaw theory.

  17. An alternative to exact renormalization equations

    OpenAIRE

    Alexandre, Jean

    2005-01-01

    An alternative point of view to exact renormalization equations is discussed, where quantum fluctuations of a theory are controlled by the bare mass of a particle. The procedure is based on an exact evolution equation for the effective action, and recovers usual renormalization results.

  18. Dimensional versus cut-off renormalization and the nucleon-nucleon interaction

    CERN Document Server

    Ghosh, A; Talukdar, B; Ghosh, Angsula; Adhikari, Sadhan K.

    1998-01-01

    The role of dimensional regularization is discussed and compared with that of cut-off regularization in some quantum mechanical problems with ultraviolet divergence in two and three dimensions with special emphasis on the nucleon-nucleon interaction. Both types of renormalizations are performed for attractive divergent one- and two-term separable potentials, a divergent tensor potential, and the sum of a delta function and its derivatives. We allow energy-dependent couplings, and determine the form that these couplings should take if equivalence between the two regularization schemes is to be enforced. We also perform renormalization of an attractive separable potential superposed on an analytic divergent potential.

  19. Dimensional versus cut-off renormalization and the nucleon-nucleon interaction

    Science.gov (United States)

    Ghosh, Angsula; Adhikari, Sadhan K.; Talukdar, B.

    1998-10-01

    The role of dimensional regularization is discussed and compared with that of cut-off regularization in some quantum mechanical problems with ultraviolet divergence in two and three dimensions with special emphasis on the nucleon-nucleon interaction. Both types of renormalizations are performed for attractive divergent one- and two-term separable potentials, a divergent tensor potential, and the sum of a delta function and its derivatives. We allow energy-dependent couplings, and determine the form that these couplings should take if equivalence between the two regularization schemes is to be enforced. We also perform renormalization of an attractive separable potential superposed on an analytic divergent potential.

  20. Surface Order Parameter Interface Hamiltonian: Renormalization of the Capillary Parameter at Complete Wetting

    Science.gov (United States)

    Boulter, C. J.; Parry, A. O.

    1995-04-01

    We consider a model of the complete wetting transition in three dimensions with short-ranged forces which allows for coupling between fluctuations in the order parameter near a substrate and the depinning interface. A renormalization group analysis shows that the effective value of our capillary parameter determining nonuniversal critical amplitudes is renormalized due to this coupling. Our results are in excellent quantitative agreement with the latest Ising model simulation studies of Binder, Landau, and Ferrenberg, which are inexplicable using a standard effective interfacial Hamiltonian model.