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We present the theoretical study of thermodynamical properties of fcc-Cu(001) substrate covered by iron-cobalt monolayer as well as by incomplete iron layer. The effective two-dimensional Heisenberg Hamiltonian is constructed from first…

材料科学 · 物理学 2015-06-12 Martin Mašín , Lars Bergqvist , Josef Kudrnovský , Miroslav Kotrla , Václav Drchal

In this study a computational method of the multi-reference VCA(virtual crystal approximation) pseudo-potential generation is presented. This is an extension of that proposed Ramer and Rappe [J. Phys. Chem. Sol. 61, 315(2000)], the scheme…

计算物理 · 物理学 2018-07-24 Akihito Kikuchi

The variational cluster approach (VCA) based on the self-energy functional theory is applied to the two-dimensional symmetric periodic Anderson model at half filling. We calculate a variety of physical quantities including the staggered…

强关联电子 · 物理学 2009-11-13 S. Horiuchi , S. Kudo , T. Shirakawa , Y. Ohta

We apply the coherent potential approximation (CPA) to a simple model for disordered superconductors with d-wave pairing. We demonstrate that whilst the effectiveness of an electronic Van Hove singularity to enhance the transition…

超导电性 · 物理学 2009-10-31 G. Litak , A. M. Martin , B. L. Gyorffy , J. F. Annett , K. I. Wysokinski

Based on some new robust estimators of the covariance matrix, we propose stable versions of Principal Component Analysis (PCA) and we qualify it independently of the dimension of the ambient space. We first provide a robust estimator of the…

统计理论 · 数学 2015-11-20 Ilaria Giulini

We establish a formal connection between the particle-particle (pp) random phase approximation (RPA) and the ladder channel of the coupled cluster doubles (CCD) equations. The relationship between RPA and CCD is best understood within a…

化学物理 · 物理学 2015-06-16 Gustavo E. Scuseria , Thomas M. Henderson , Ireneusz W. Bulik

We present a quantum-classical hybrid algorithm that simulates electronic structures of periodic systems such as ground states and quasiparticle band structures. By extending the unitary coupled cluster (UCC) theory to describe crystals in…

量子物理 · 物理学 2022-02-16 Nobuyuki Yoshioka , Takeshi Sato , Yuya O. Nakagawa , Yu-ya Ohnishi , Wataru Mizukami

We study the three-band Hubbard model for the copper oxide plane of the high-temperature superconducting cuprates using determinant quantum Monte Carlo and the dynamical cluster approximation (DCA) and provide a comprehensive view of the…

超导电性 · 物理学 2021-04-28 Peizhi Mai , Giovanni Balduzzi , Steven Johnston , Thomas A. Maier

We consider a compression method for boundary element matrices arising in the context of the computation of electrostatic fields. Green cross approximation combines an analytic approximation of the kernel function based on Green's…

数值分析 · 数学 2018-10-22 Steffen Börm , Sven Christophersen

We develop a microscopic theory of disorder-induced localization for a quantum particle moving in a fully ionized classical one-component plasma, within the static-fluctuation approximation. The random potential acting on the particle…

等离子体物理 · 物理学 2026-05-19 Yury A. Budkov

Tensor robust principal component analysis (TRPCA) is a fundamental model in machine learning and computer vision. Recently, tensor train (TT) decomposition has been verified effective to capture the global low-rank correlation for tensor…

机器学习 · 计算机科学 2022-03-14 Yuning Qiu , Guoxu Zhou , Zhenhao Huang , Qibin Zhao , Shengli Xie

We propose the $\pi$ flux triangular lattice Hubbard model ($\pi$-THM) as a prototypical setup to stabilize magnetically disordered quantum states of matter in the presence of charge fluctuations. The quantum paramagnetic domain of the…

强关联电子 · 物理学 2015-05-20 Stephan Rachel , Manuel Laubach , Johannes Reuther , Ronny Thomale

We discuss the Hubbard model in an applied magnetic field and analyze the properties of neutral spin-1/2 fermions within the so-called statistically consistent Gutzwiller approximation (SGA). The magnetization curve reproduces in a…

强关联电子 · 物理学 2014-07-28 Marcin M. Wysokinski , Jozef Spalek

The nuclear wobbling motion in the Lu region is studied by the microscopic cranked mean-field plus RPA method. The Woods-Saxon potential is used as a mean-field with a new parameterization which gives reliable description of rapidly…

核理论 · 物理学 2009-11-11 Takuya Shoji , Yoshifumi R. Shimizu

We formulate a low-energy theory for the magnetic interactions between electrons in the multi-band Hubbard model under non-equilibrium conditions determined by an external time-dependent electric field which simulates laser-induced spin…

强关联电子 · 物理学 2013-04-11 Andrea Secchi , Sergei Brener , Alexander I. Lichtenstein , Mikhail I. Katsnelson

Dynamical quantum-cluster approaches, such as different cluster extensions of the dynamical mean-field theory (cluster DMFT) or the variational cluster approximation (VCA), combined with efficient cluster solvers, such as the quantum…

强关联电子 · 物理学 2013-05-29 Gang Li , Werner Hanke , Alexei N. Rubtsov , Sebastian Bäse , Michael Potthoff

Magnetization process of the Gutzwiller wave function is studied accurately by a variational Monte Carlo method. We apply it to the one-dimensional (1D) and 2D Hubbard models (HM), and to the 1D periodic Anderson model (PAM) without orbital…

凝聚态物理 · 物理学 2007-05-23 Hisatoshi Yokoyma , Shinya Tokizaki

The Hubbard model, which augments independent-electron band theory with a single parameter to describe electron-electron correlations, is widely regarded to be the `standard model' of condensed matter physics. The model has been remarkably…

强关联电子 · 物理学 2016-02-17 S. M. Griffin , P. Staar , T. C. Schulthess , M. Troyer , N. A. Spaldin

The approach to quantum mechanics which we have used to derive the matrix treatment of spin from first principles is now employed to treat systems of compounded angular momentum. A general treatment is first given, which is then applied to…

量子物理 · 物理学 2007-05-23 Habatwa Vincent Mweene

Physics of high-$T_c$ superconducting cuprates is obscured by the effect of strong electronic correlations. One way to overcome the problem is to seek for an exact solution at least within the small cluster and expand it to the whole…

强关联电子 · 物理学 2023-07-19 V. I. Kuz'min , S. V. Nikolaev , M. M. Korshunov , S. G. Ovchinnikov