English
Related papers

Related papers: Restricted Open-shell cluster Mean-Field theory fo…

200 papers

We explore different variants of the random phase approximation (RPA) to the correlation energy derived from closed-shell ring-diagram approximations to coupled cluster doubles theory. We implement these variants in range-separated…

Chemical Physics · Physics 2011-09-01 Julien Toulouse , Wuming Zhu , Andreas Savin , Georg Jansen , János G. Angyán

Non-negative matrix factorization (NMF) is a popular unsupervised learning approach widely used in image clustering. However, in real-world clustering scenarios, most existing NMF methods are highly sensitive to noise corruption and are…

Computer Vision and Pattern Recognition · Computer Science 2025-05-01 Jingjing Liu , Nian Wu , Xianchao Xiu , Jianhua Zhang

The coupled cluster method (CCM) has previously been applied to study the ground- and excited-state properties of many different types of frustrated and unfrustrated quantum spin systems. A common feature in the application of the CCM is to…

Strongly Correlated Electrons · Physics 2014-02-20 Damian J. J. Farnell , Andrew I. Croudace

Mean-field theory (MFT) is one of the main available tools for analytical calculations entailed in investigations regarding many-body systems. Recently, there have been an urge of interest in ameliorating this kind of method, mainly with…

Statistical Mechanics · Physics 2016-06-14 F. M. Zimmer , M. Schmidt , Jonas Maziero

We revisit the cellular dynamical mean-field theory (CDMFT) for the single band Hubbard model on the square lattice at half filling, reaching real-space cluster sizes of up to 9 x 9 sites. Using benchmarks against direct lattice…

Strongly Correlated Electrons · Physics 2020-09-30 Marcel Klett , Nils Wentzell , Thomas Schäfer , Fedor Simkovic , Olivier Parcollet , Sabine Andergassen , Philipp Hansmann

The cranked relativistic mean field (CRMF) theory is applied for the description of superdeformed (SD) rotational bands observed in $^{153}$Ho. The question of the structure of the so-called SD band in $^{154}$Er is also addressed and a…

Nuclear Theory · Physics 2009-10-31 A. V. Afanasjev , P. Ring

A collision-induced magnetic reconnection (CMR) mechanism was recently proposed to explain the formation of a filament in the Orion A molecular cloud. In this mechanism, a collision between two clouds with antiparallel magnetic fields…

Astrophysics of Galaxies · Physics 2022-10-26 Shuo Kong , David Whitworth , Rowan J. Smith , Erika T. Hamden

We develop, clarify and test various aspects of cluster methods dynamical mean field methods using a soluble toy model as a benchmark. We find that the Cellular Dynamical Mean Field Theory (C-DMFT) converges very rapidly and compare its…

Strongly Correlated Electrons · Physics 2009-11-07 Giulio Biroli , Gabriel Kotliar

Quantum-chemical calculations aimed at deriving magnetic coupling constants in exchange-coupled spin clusters commonly utilize a broken-symmetry (BS) approach. This involves calculating several distinct collinear spin configurations,…

Strongly Correlated Electrons · Physics 2023-10-23 Shadan Ghassemi Tabrizi

Mean field approach, although a generally reliable tool that captures major short range correlations, often fails in symmetric low dimensional strongly correlated electronic systems like those described by the Hubbard model. In these…

Strongly Correlated Electrons · Physics 2019-09-25 Baruch Rosenstein , Dingping Li , Tianxing Ma , H. C. Kao

We propose an entanglement mean field theory inspired approach for dealing with interacting classical many-body systems. It involves a coarse-graining technique that terminates a step before the mean field theory: While mean field theory…

Strongly Correlated Electrons · Physics 2013-07-12 Aditi Sen De , Ujjwal Sen

A general-order open-shell coupled-cluster method based on spatial orbitals is formulated. The method is an extension of the partial-spin adaptation (PSA) scheme from Janssen and Schaefer (Theor. Chim. Acta, 79, 1-42, 1991). By increasing…

Chemical Physics · Physics 2024-03-18 Cong Wang

In this paper, we have considered the mechanical stability of a jellium system in the presence of spin degrees of freedom and have generalized the stabilized jellium model, introduced by J. P. Perdew, H. Q. Tran, and E. D. Smith [Phys. Rev.…

Materials Science · Physics 2009-10-30 M. Payami , N. Nafari

An externally corrected coupled cluster (CC) method, where an adaptive configuration interaction (ACI) wave function provides the external cluster amplitudes, named ACI-CC, is presented. By exploiting the connection between configuration…

Chemical Physics · Physics 2023-09-27 Gustavo J. R. Aroeira , Madeline M. Davis , Justin M. Turney , Henry F. Schaefer

We discuss the stochastic mean-field theory (SMFT) method which is a new approach for describing disordered Bose systems in the thermodynamic limit including localization and dimensional effects. We explicate the method in detail and apply…

Disordered Systems and Neural Networks · Physics 2010-07-09 Ulf Bissbort , Ronny Thomale , Walter Hofstetter

Restricted open-shell Hartree-Fock (ROHF) theory is formulated as a projected self-consistent unrestricted HF (UHF) model by mathematically constraining spin density eigenvalues. The resulting constrained UHF (CUHF) wave function is…

Strongly Correlated Electrons · Physics 2015-05-19 Takashi Tsuchimochi , Gustavo E. Scuseria

We show that short-range correlations have a dramatic impact on the steady-state phase diagram of quantum driven-dissipative systems. This effect, never observed in equilibrium, follows from the fact that ordering in the steady state is of…

Statistical Mechanics · Physics 2016-07-29 Jiasen Jin , Alberto Biella , Oscar Viyuela , Leonardo Mazza , Jonathan Keeling , Rosario Fazio , Davide Rossini

The local form of higher-spin equations found recently to the second order [1] is shown to properly reproduce the anticipated $AdS/CFT$ correlators for appropriate boundary conditions. It is argued that consistent $AdS/CFT$ holography for…

High Energy Physics - Theory · Physics 2017-12-06 V. E. Didenko , M. A. Vasiliev

We present a novel approach to spin-adapted coupled cluster theory. This approach is based on the entanglement of an open-shell molecule with electrons in a non-interacting bath; together they form a closed-shell state. For the total…

Chemical Physics · Physics 2023-05-22 Sarai Dery Folkestad , Bendik Støa Sannes , Henrik Koch

In this work, we theoretically demonstrate that a strong enhancement of the Magnetocaloric Effect is achieved in geometrically frustrated cluster spin-glass systems just above the freezing temperature. We consider a network of clusters…

Disordered Systems and Neural Networks · Physics 2023-05-24 F. M. Zimmer , R. Mourao , M. Schmidt , M. A. Tumelero , S. G. Magalhaes