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Calculation of amplitudes in perturbative quantum field theory involve large loop integrals. The complexity of those integrals, in combination with the large number of Feynman diagrams, make the calculations very difficult. Reduction…

高能物理 - 唯象学 · 物理学 2015-06-05 Ronald H. P. Kleiss , Ioannis Malamos , Costas G. Papadopoulos , Rob Verheyen

An extensive analysis has been carried out of the performance of standard families of basis sets with the hierarchy of coupled cluster methods CC2, CCSD, CC3 and CCSDT in computing selected Oxygen, Carbon and Nitrogen K-edge (vertical) core…

化学物理 · 物理学 2019-08-13 Johanna P. Carbone , Lan Cheng , Rolf H. Myhre , Devin Matthews , Henrik Koch , Sonia Coriani

Precision tests of the Standard Model and searches for beyond the Standard Model physics often require nuclear structure input. There has been a tremendous progress in the development of nuclear ab initio techniques capable of providing…

核理论 · 物理学 2022-01-05 Petr Navratil

We describe a modification of the stochastic coupled cluster algorithm that allows the use of multiple reference determinants. By considering the secondary references as excitations of the primary reference and using them to change the…

化学物理 · 物理学 2020-10-22 Maria-Andreea Filip , Charles J. C. Scott , Alex J. W. Thom

Ab initio nuclear physics tackles the problem of strongly interacting four-component fermions. The same setting could foreseeably be probed experimentally in ultracold atomic systems, where two- and three-component experiments have led to…

量子气体 · 物理学 2020-04-16 William G. Dawkins , J. Carlson , U. van Kolck , Alexandros Gezerlis

The impact of applying state-of-the-art tensor factorization techniques to modern nuclear Hamiltonians derived from chiral effective field theory is investigated. Subsequently, the error induced by the tensor decomposition of the input…

核理论 · 物理学 2019-03-27 Alexander Tichai , Roman Schutski , Gustavo E. Scuseria , Thomas Duguet

We employ the closed-shell perturbed relativistic coupled-cluster (RCC) theory developed by us earlier [Phys. Rev. A {\bf 77}, 062516 (2008)] to evaluate the ground state static electric dipole polarizabilities (\alpha s) of several atomic…

原子物理 · 物理学 2013-12-09 Yashpal Singh , B. K. Sahoo , B. P. Das

Coupled cluster theory is one of the most accurate electronic structure methods for predicting ground and excited state chemistry. However, the presence of numerical artifacts at electronic degeneracies, such as complex energies, has made…

化学物理 · 物理学 2024-05-16 Eirik F. Kjønstad , Sara Angelico , Henrik Koch

The most efficient known quantum circuits for preparing unitary coupled cluster states and applying Trotter steps of the arbitrary basis electronic structure Hamiltonian involve interleaved sequences of fermionic Gaussian circuits and Ising…

量子物理 · 物理学 2021-09-13 Nicholas C. Rubin , Joonho Lee , Ryan Babbush

We apply the coupled cluster method (CCM) to the Hamiltonian version of the latticised O(4) non-linear sigma model. The method, which was initially developed for the accurate description of quantum many-body systems, gives rise to two…

高能物理 - 格点 · 物理学 2009-10-30 N. E. Ligterink , N. R. Walet , R. F. Bishop

We extend our assessment of the potential of perturbative coupled cluster (CC) expansions for a test set of open-shell atoms and organic radicals to the description of quadruple excitations. Namely, the second- through sixth-order models of…

化学物理 · 物理学 2016-05-17 Janus J. Eriksen , Devin A. Matthews , Poul Jørgensen , Jürgen Gauss

We consider a class of finite element approximations for fourth-order parabolic equations that can be written as a system of second-order equations by introducing an auxiliary variable. In our approach, we first solve a variational problem…

数值分析 · 数学 2021-06-30 Sana Keita , Abdelaziz Beljadid , Yves Bourgault

An alternative perturbative expansion in quantum mechanics which allows a full expression of the scaling arbitrariness is introduced. This expansion is examined in the case of the anharmonic oscillator and is conveniently resummed using a…

高能物理 - 理论 · 物理学 2015-06-26 J. M. Prats

We present a systematic hierarchy of approximations for {\it local} exact-decoupling of four-component quantum chemical Hamiltonians based on the Dirac equation. Our ansatz reaches beyond the trivial local approximation that is based on a…

化学物理 · 物理学 2012-06-28 Daoling Peng , Markus Reiher

We study quantum loop corrections to two-point functions and extraction of physical quantities in a five-dimensional $\phi^4$ theory on an orbifold. At two-loop level, we find that divergence for quartic derivative terms of $(p^2)^2$ appear…

高能物理 - 唯象学 · 物理学 2009-12-04 Nobuhiro Uekusa

Self-consistent perturbation expansion up to the second order in the interaction strength is used to study a single-level quantum dot with local Coulomb repulsion attached asymmetrically to two generally different superconducting leads. At…

介观与纳米尺度物理 · 物理学 2016-02-02 Martin Žonda , Vladislav Pokorný , Václav Janiš , Tomáš Novotný

Higher-order perturbative calculations in Quantum (Field) Theory suffer from the factorial increase of the number of individual diagrams. Here I describe an approach which evaluates the total contribution numerically for finite temperature…

高能物理 - 理论 · 物理学 2017-08-23 R. Rosenfelder

Using staggered fermions, we calculate the perturbative corrections to the bilinear and four-fermion operators that are used in the numerical study of weak matrix elements for $\epsilon'/\epsilon$. We present results for one-loop matching…

高能物理 - 格点 · 物理学 2014-11-17 Weonjong Lee

In this paper a library for spin--angular integration in LS-coupling for many-electron atoms is presented. The software is an implementation of a methodology based on the second quantization in coupled tensorial form, the angular momentum…

原子物理 · 物理学 2007-05-23 G. Gaigalas

We develop a multipoint stress mixed finite element method for linear elasticity with weak stress symmetry on quadrilateral grids, which can be reduced to a symmetric and positive definite cell centered system. The method is developed on…

数值分析 · 数学 2019-08-06 Ilona Ambartsumyan , Eldar Khattatov , Jan M. Nordbotten , Ivan Yotov