Electronic structure calculations with dynamical mean-field theory

被引:2093
作者
Kotliar, G.
Savrasov, S. Y.
Haule, K.
Oudovenko, V. S.
Parcollet, O.
Marianetti, C. A.
机构
[1] Rutgers State Univ, Dept Phys & Astron, Piscataway, NJ 08854 USA
[2] Rutgers State Univ, Ctr Condensed Matter Theory, Piscataway, NJ 08854 USA
[3] CEA Saclay, Serv Phys Theor, F-91191 Gif Sur Yvette, France
[4] Ecole Polytech, Ctr Phys Theor, F-91128 Palaiseau, France
[5] Univ Calif Davis, Dept Phys, Davis, CA 95616 USA
[6] Jozef Stefan Inst, SI-1000 Ljubljana, Slovenia
[7] Joint Inst Nucl Res, Bogoliubov Lab Theoret Phys, Dubna 141980, Russia
[8] CEA Saclay, CNRS,URA 2306,SPM, DSM SPhT, Serv Phys Theor, F-91191 Gif Sur Yvette, France
关键词
D O I
10.1103/RevModPhys.78.865
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
A review of the basic ideas and techniques of the spectral density-functional theory is presented. This method is currently used for electronic structure calculations of strongly correlated materials where the one-electron description breaks down. The method is illustrated with several examples where interactions play a dominant role: systems near metal-insulator transitions, systems near volume collapse transitions, and systems with local moments.
引用
收藏
页码:865 / 951
页数:87
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