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Related papers: Continuum coupled cluster expansion

200 papers

A cluster expansion is proposed, that applies to both continuous and discrete systems. The assumption for its convergence involves an extension of the neat Kotecky-Preiss criterion. Expressions and estimates for correlation functions are…

Mathematical Physics · Physics 2007-05-23 Daniel Ueltschi

We develop a novel cluster expansion for finite-spin lattice systems subject to multi-body quantum -- and, in particular, classical -- interactions. Our approach is based on the use of ``decoupling parameters", advocated by Park [34], which…

Mathematical Physics · Physics 2023-07-21 Nguyen Tong Xuan , Roberto Fernandez

Correlations in interacting many-particle systems can lead to the formation of clusters, in particular bound states and resonances. Systematic quantum statistical approaches allow to combine the nuclear statistical equilibrium description…

Nuclear Theory · Physics 2013-01-11 G. Ropke , N. -U. Bastian , D. Blaschke , T. Klahn , S. Typel , H. H. Wolter

Quantum cluster approaches offer new perspectives to study the complexities of macroscopic correlated fermion systems. These approaches can be understood as generalized mean-field theories. Quantum cluster approaches are non-perturbative…

Strongly Correlated Electrons · Physics 2009-11-10 Th. Maier , M. Jarrell , Th. Pruschke , M. H. Hettler

The challenging nuclear many-body problem is discussed along with classifications and qualitative descriptions of existing methods and models. We present detailed derivations of a new method where cluster correlations co-exist with an…

Nuclear Theory · Physics 2018-07-04 D. Hove , E. Garrido , P. Sarriguren , D. V. Fedorov , H. O. U. Fynbo , A. S. Jensen , N. T. Zinner

Introducing an active space approximation is inevitable for the quantum computations of chemical systems. However, this approximation ignores the electron correlations related to non-active orbitals. Here, we propose a computational method…

Quantum Physics · Physics 2024-06-06 Luca Erhart , Yuichiro Yoshida , Viktor Khinevich , Wataru Mizukami

We have recently extended many-body perturbation theory and coupled-cluster theory performed on top of a Slater determinant breaking rotational symmetry to allow for the restoration of the angular momentum at any truncation order [T.…

Nuclear Theory · Physics 2015-12-10 T. Duguet , A. Signoracci

The Coupled-Cluster theory is one of the most successful high precision methods used to solve the stationary Schr\"odinger equation. In this article, we address the mathematical foundation of this theory with focus on the advances made in…

Chemical Physics · Physics 2019-09-04 Andre Laestadius , Fabian M. Faulstich

The unitary coupled cluster (UCC) approximation is one of the more promising wave-function ans\"atze for electronic structure calculations on quantum computers via the variational quantum eigensolver algorithm. However, for large systems…

Quantum Physics · Physics 2021-09-30 Jia Chen , Hai-Ping Cheng , James K. Freericks

Methods which aim at universal applicability must be able to describe both weak and strong electronic correlation with equal facility. Such methods are in short supply. The combination of symmetry projection for strong correlation and…

Chemical Physics · Physics 2020-05-14 Yiheng Qiu , Thomas M. Henderson , Jinmo Zhao , Gustavo E. Scuseria

A well-known cluster expansion, which leads to virial expansion for the free energy of low density systems, is modified in such a way that it becomes applicable to the description of condensed state of matter. To this end, the averaging of…

Statistical Mechanics · Physics 2018-12-21 G. S. Bokun , M. F. Holovko

Recent progress in the numerical solution of the nuclear many-body problem and in the development of nuclear Hamiltonians rooted in Quantum Chromodynamics, has opened the door to first-principle computations of nuclear reactions. In this…

Nuclear Theory · Physics 2020-07-24 J. Rotureau

We develop the continuum mechanics of quantum many-body systems in the linear response regime. The basic variable of the theory is the displacement field, for which we derive a closed equation of motion under the assumption that the…

Strongly Correlated Electrons · Physics 2015-05-13 Jianmin Tao , Xianlong Gao , G. Vignale , I. V. Tokatly

In classical computational chemistry, the coupled-cluster ansatz is one of the most commonly used $ab~initio$ methods, which is critically limited by its non-unitary nature. The unitary modification as an ideal solution to the problem is,…

Quantum Physics · Physics 2017-03-01 Yangchao Shen , Xiang Zhang , Shuaining Zhang , Jing-Ning Zhang , Man-Hong Yung , Kihwan Kim

We address the fundamental interplay between indistinguishability and interactions when discreteness effects are neglected in systems with strictly fixed number of particles. For this end we supplement cluster expansions (many-body…

Quantum Physics · Physics 2016-03-10 Quirin Hummel , Juan Diego Urbina , Klaus Richter

A full coupled-cluster expansion suitable for sparse algebraic operations is developed by expanding the commutators of the Baker-Campbell-Hausdorff series explicitly for cluster operators in binary representations. A full coupled-cluster…

Chemical Physics · Physics 2018-09-13 Enhua Xu , Motoyuki Uejima , Seiichiro L. Ten-no

We consider the sampling of the coupled cluster expansion within stochastic coupled cluster theory. Observing the limitations of previous approaches due to the inherently non-linear behaviour of a coupled cluster wavefunction representation…

Chemical Physics · Physics 2018-08-14 Charles J. C. Scott , Alex J. W. Thom

We introduce a novel many body method which combines two powerful many body techniques, viz., quantum Monte Carlo and coupled cluster theory. Coupled cluster wave functions are introduced as importance functions in a Monte Carlo method…

Nuclear Theory · Physics 2013-12-04 Alessandro Roggero , Abhishek Mukherjee , Francesco Pederiva

This contribution gives a short review of recent theoretical advances in most topics of nuclear cluster physics concentrating, however, around {$\alpha$} particle clustering. Along the route, the point of view will be critical mentioning…

Nuclear Theory · Physics 2018-11-29 P. Schuck

The established approach of perturbative continuous unitary transformations (pCUTs) constructs effective quantum many-body Hamiltonians as perturbative series that conserve the number of one quasiparticle type. We extend the pCUT method to…

Strongly Correlated Electrons · Physics 2023-10-05 L. Lenke , A. Schellenberger , K. P. Schmidt