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We describe a method for imposing the correct electron-nucleus (e-n) cusp in molecular orbitals expanded as a linear combination of (cuspless) Gaussian basis functions. Enforcing the e-n cusp in trial wave functions is an important asset in…

Chemical Physics · Physics 2020-06-05 Pierre-François Loos , Anthony Scemama , Michel Caffarel

A detailed description of the numerical procedure is presented for the evaluation of the one-loop self-energy correction to the $g$-factor of an electron in the $1s$ and $2s$ states in H-like ions to all orders in $Z\alpha$.

Atomic Physics · Physics 2007-05-23 Paul Indelicato , V. A. Yerokhin , V. Shabaev

We investigate the self-energy of one electron coupled to a quantized radiation field by extending the ideas developed recently by C. Hainzl. We fix an arbitrary cut-off parameter Lambda and recover the alpha^2-term of the self-energy,…

Mathematical Physics · Physics 2007-05-23 I. Catto , Ch. Hainzl

In this paper, we consider the Dirac-Coulomb equation for many-particles, to describe the interaction between electrons in the system having many electrons. The four-component wave function will expanding into a finite basis-set, using…

Quantum Physics · Physics 2019-12-10 Bilal K. Jasim , Ayad A. Al-Ani , Saad N. Abood

It is shown how the QED concept of a gauge-, scale- and scheme-independent one-loop effective charge can be extended directly at the diagrammatic level to QCD, thus justifying explicitly the ``naive non-abelianization'' prescription used in…

High Energy Physics - Phenomenology · Physics 2008-11-26 N. J. Watson

Within a systematic approach based on nonrelativistic quantum electrodynamics (NRQED), we derive the one-loop self-energy correction of order alpha (Zalpha)^4 to the bound-electron g factor. In combination with numerical data, this analytic…

High Energy Physics - Phenomenology · Physics 2007-05-23 K. Pachucki , U. D. Jentschura , V. A. Yerokhin

In this talk, the program package GOSAM is presented, which can be used for the automated calculation of one-loop amplitudes for multi-particle processes. The integrands are generated in terms of Feynman diagrams and can be reduced by…

High Energy Physics - Phenomenology · Physics 2012-01-19 G. Cullen , N. Greiner , G. Heinrich , G. Luisoni , P. Mastrolia , G. Ossola , T. Reiter , F. Tramontano

Two-loop self-energy corrections to the bound-electron $g$ factor are investigated theoretically to all orders in the nuclear binding strength parameter $Z\alpha$. The separation of divergences is performed by dimensional regularization,…

Atomic Physics · Physics 2020-01-08 B. Sikora , V. A. Yerokhin , N. S. Oreshkina , H. Cakir , C. H. Keitel , Z. Harman

We consider the three fundamental one loop Feynman diagrams of QED viz. vertex correction, fermion self-energy and vacuum polarization in the light-front gauge and discuss the equivalence of their standard covariant expressions with the…

High Energy Physics - Theory · Physics 2022-03-29 Deepesh Bhamre , Anuradha Misra

We introduce highly local basis sets for electronic structure which are very efficient for correlation calculations near the complete basis set limit. Our approach is based on gausslets, recently introduced wavelet-like smooth orthogonal…

Chemical Physics · Physics 2019-02-20 Steven R. White , E. Miles Stoudenmire

The $\epsilon$-expansion of several two-loop self-energy diagrams with different thresholds and one mass are calculated. On-shell results are reduced to multiple binomial sums which values are presented in analytical form.

High Energy Physics - Theory · Physics 2009-10-31 M. Yu. Kalmykov , O. Veretin

Electronic structure methods for accurate calculation of molecular properties have a high cost that grows steeply with the problem size, therefore, it is helpful to have the underlying atomic basis functions that are less in number but of…

Chemical Physics · Physics 2019-03-15 Dimitri N. Laikov

We discuss a simple procedure for computing one-loop quantum energies of any static field configuration that depends non-trivially on only a single spatial coordinate. We specifically focus on domain wall-type field configurations that…

High Energy Physics - Theory · Physics 2009-10-31 Andrei Parnachev , Laurence G. Yaffe

We compute the electron self-energy in Quantum Electrodynamics to three loops in terms of iterated integrals over kernels of elliptic type. We make use of the differential equations method, augmented by an $\epsilon$-factorized basis, which…

High Energy Physics - Theory · Physics 2024-11-08 Claude Duhr , Federico Gasparotto , Christoph Nega , Lorenzo Tancredi , Stefan Weinzierl

We perform a detailed analysis of one-loop corrections to the self-energy of the (off-shell) gauge bosons in six-dimensional N=1 supersymmetric gauge theories on orbifolds. After discussing the Abelian case in the standard Feynman diagram…

High Energy Physics - Phenomenology · Physics 2009-11-11 Dumitru M. Ghilencea , Hyun Min Lee , Kai Schmidt-Hoberg

The one-loop self-energy correction to the 1s electron g factor is evaluated to all orders in Z\alpha with an accuracy, which is essentially better than that of previous calculations of this correction. As a result, the uncertainty of the…

High Energy Physics - Phenomenology · Physics 2009-11-07 V. A. Yerokhin , P. Indelicato , V. M. Shabaev

In this paper we consider the evaluation of the Araki-Sucher correction for arbitrary many-electron atomic and molecular systems. This contribution appears in the leading order quantum electrodynamics corrections to the energy of a bound…

Chemical Physics · Physics 2017-12-06 Justyna G. Balcerzak , Michał Lesiuk , Robert Moszynski

Assuming high temperature and taking subleading temperature dependence into account, gauge dependence of one-loop electron dispersion relation is investigated in massless QED at zero chemical potential. The analysis is carried out using a…

High Energy Physics - Phenomenology · Physics 2009-10-31 Indrajit Mitra

A general procedure for the optimization of atomic density-fitting basis functions is designed with the balance between accuracy and numerical stability in mind. Given one-electron wavefunctions and energies, weights are assigned to the…

Chemical Physics · Physics 2020-10-13 Dimitri N. Laikov

The main quasi-particle characteristics of the one-dimensional polaron are estimated within and beyond the most general Gaussian approximation at arbitrary electron-phonon coupling. We have derived explicitly the ground-state energy and the…

Condensed Matter · Physics 2007-05-23 G. Ganbold