Finite-temperature magnetism of transition metals:: An ab initio dynamical mean-field theory -: art. no. 067205

被引:348
作者
Lichtenstein, AI
Katsnelson, MI [1 ]
Kotliar, G
机构
[1] Univ Nijmegen, NL-6525 ED Nijmegen, Netherlands
[2] Rutgers State Univ, Serin Phys Lab, Piscataway, NJ 08855 USA
[3] Russian Acad Sci, Inst Met Phys, Ekaterinburg 620219, Russia
关键词
D O I
10.1103/PhysRevLett.87.067205
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
We present an ab initio quantum theory of the finite-temperature magnetism of iron and nickel. A recently developed technique which combines dynamical mean-field theory with realistic electronic structure methods successfully describes the many-body features of the one electron spectra and the observed magnetic moments below and above the Curie temperature.
引用
收藏
页码:67205 / 1
页数:4
相关论文
共 35 条
[1]   Enhanced spin polarization of conduction electrons in Ni explained by comparison with Cu [J].
Altmann, KN ;
Petrovykh, DY ;
Mankey, GJ ;
Shannon, N ;
Gilman, N ;
Hochstrasser, M ;
Willis, RF ;
Himpsel, FJ .
PHYSICAL REVIEW B, 2000, 61 (23) :15661-15666
[2]   EXPLICIT, 1ST-PRINCIPLES TIGHT-BINDING THEORY [J].
ANDERSEN, OK ;
JEPSEN, O .
PHYSICAL REVIEW LETTERS, 1984, 53 (27) :2571-2574
[3]   First-principles calculations of the electronic structure and spectra of strongly correlated systems: dynamical mean-field theory [J].
Anisimov, VI ;
Poteryaev, AI ;
Korotin, MA ;
Anokhin, AO ;
Kotliar, G .
JOURNAL OF PHYSICS-CONDENSED MATTER, 1997, 9 (35) :7359-7367
[4]   Spin dynamics in magnets: Equation of motion and finite temperature effects [J].
Antropov, VP ;
Katsnelson, MI ;
Harmon, BN ;
vanSchilfgaarde, M ;
Kusnezov, D .
PHYSICAL REVIEW B, 1996, 54 (02) :1019-1035
[5]   SELF-ENERGY OF FERROMAGNETIC NICKEL IN THE GW APPROXIMATION [J].
ARYASETIAWAN, F .
PHYSICAL REVIEW B, 1992, 46 (20) :13051-13064
[6]   CALCULATION OF COULOMB INTERACTION STRENGTHS FOR 3D TRANSITION-METALS AND ACTINIDES [J].
BANDYOPADHYAY, T ;
SARMA, DD .
PHYSICAL REVIEW B, 1989, 39 (06) :3517-3521
[7]   Low-frequency crossover of the fractional power-law conductivity in SrRuO3 [J].
Dodge, JS ;
Weber, CP ;
Corson, J ;
Orenstein, J ;
Schlesinger, Z ;
Reiner, JW ;
Beasley, MR .
PHYSICAL REVIEW LETTERS, 2000, 85 (23) :4932-4935
[8]   Dynamical mean-field theory of strongly correlated fermion systems and the limit of infinite dimensions [J].
Georges, A ;
Kotliar, G ;
Krauth, W ;
Rozenberg, MJ .
REVIEWS OF MODERN PHYSICS, 1996, 68 (01) :13-125
[9]   Adiabatic spin dynamics from spin-density-functional theory: Application to Fe, Co, and Ni [J].
Halilov, SV ;
Eschrig, H ;
Perlov, AY ;
Oppeneer, PM .
PHYSICAL REVIEW B, 1998, 58 (01) :293-302
[10]   LOCAL APPROACH TO ELECTRON CORRELATIONS IN FERROMAGNETIC NICKEL [J].
IGARASHI, J ;
UNGER, P ;
HIRAI, K ;
FULDE, P .
PHYSICAL REVIEW B, 1994, 49 (23) :16181-16190