Implementing the density matrix embedding theory with the hierarchical mean-field approach

被引:3
|
作者
Qin, Jingbo [1 ]
Jie, Quanlin [1 ]
Fan, Zhuo [2 ]
机构
[1] Wuhan Univ, Dept Phys, Wuhan 430072, Peoples R China
[2] Hubei Univ Sci & Technol, Sch Biomed Engn, Xianning 437100, Peoples R China
基金
美国国家科学基金会;
关键词
Density matrix embedding theory; Hierarchical mean-field; Infinite lattice; Spin model;
D O I
10.1016/j.cpc.2016.03.004
中图分类号
TP39 [计算机的应用];
学科分类号
081203 ; 0835 ;
摘要
We show an implementation of density matrix embedding theory (DMET) for the spin lattice of infinite size. It is indeed a special form of hierarchical mean-field (HMF) theory. In the method, we divide the lattice into a small part and a large part. View the small part as an impurity, embedding in the large part, which is viewed as the environment. We deal the impurity with a high accuracy method. But treat the environment with a low-level method: the states of the environment nearby the impurity are expressed by a set of multiple block product states, while the distant parts are treated by mean-field consideration. Our method allows for the computation of the ground state of the infinite two-dimensional quantum spin systems. In the text, we take the frustrated Heisenberg model as an example to test our method. The ground state energy we calculated can reach a high accuracy. We also calculate the magnetization, and the fidelity to study the quantum phase transitions. (C) 2016 Elsevier B.V. All rights reserved.
引用
收藏
页码:38 / 42
页数:5
相关论文
共 50 条
  • [1] Density Matrix Embedding: A Simple Alternative to Dynamical Mean-Field Theory
    Knizia, Gerald
    Chan, Garnet Kin-Lic
    PHYSICAL REVIEW LETTERS, 2012, 109 (18)
  • [2] Density-matrix mean-field theory
    Zhang, Junyi
    Cheng, Zhengqian
    SCIPOST PHYSICS, 2024, 17 (02):
  • [3] A unified density matrix functional construction of quantum baths in density matrix embedding theory beyond the mean-field approximation
    Sekaran, Sajanthan
    Bindech, Oussama
    Fromager, Emmanuel
    JOURNAL OF CHEMICAL PHYSICS, 2023, 159 (03):
  • [4] Dynamical mean-field theory, density-matrix embedding theory, and rotationally invariant slave bosons: A unified perspective
    Ayral, Thomas
    Lee, Tsung-Han
    Kotliar, Gabriel
    PHYSICAL REVIEW B, 2017, 96 (23)
  • [5] Embedding approach for dynamical mean-field theory of strongly correlated heterostructures
    Ishida, H.
    Liebsch, A.
    PHYSICAL REVIEW B, 2009, 79 (04)
  • [6] Mean-field density matrix decompositions
    Eriksen, Janus J.
    JOURNAL OF CHEMICAL PHYSICS, 2020, 153 (21):
  • [7] Mean-field dynamical density functional theory
    Dzubiella, J
    Likos, CN
    JOURNAL OF PHYSICS-CONDENSED MATTER, 2003, 15 (06) : L147 - L154
  • [8] Fock-Matrix Corrections in Density Functional Theory and Use in Embedded Mean-Field Theory
    Miyamoto, Kaito
    Miller, Thomas F., III
    Manby, Frederick R.
    JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2016, 12 (12) : 5811 - 5822
  • [9] Dynamical mean-field theory calculation with the dynamical density-matrix renormalization group
    Nishimoto, S
    Gebhard, F
    Jeckelmann, E
    PHYSICA B-CONDENSED MATTER, 2006, 378-80 (SPEC. ISS.) : 283 - 285
  • [10] Hierarchical mean-field theories
    Ortiz, G
    Batista, CD
    CONDENSED MATTER THEORIES, VOL 18, 2003, : 225 - 234