Efficient total energy calculations from self-energy models

Physical Review Letters

Volumn 85, Issue 26, 2000, Pages 5611-5614

  Sánchez Friera, Paula ^a   Godby, R W ^a  

^a UNIVERSITY OF YORK   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; ELECTRON GAS; GREEN'S FUNCTION; MATHEMATICAL MODELS; MOLECULAR DYNAMICS; MONTE CARLO METHODS; PERTURBATION TECHNIQUES; PROBABILITY DENSITY FUNCTION; QUANTUM THEORY; SEMICONDUCTING SILICON;

GENERALIZED GRADIENT APPROXIMATIONS; INTERACTING ELECTRONS; KOHN-SHAM SCHEME; LOCAL DENSITY APPROXIMATIONS; MANY BODY PERTURBATION THEORY; SELF ENERGY MODELS; TOTAL ENERGY CALCULATIONS;

ELECTRON ENERGY LEVELS;

ARTICLE;

EID: 0342936094     PISSN: 00319007     EISSN: None     Source Type: Journal    
DOI: 10.1103/PhysRevLett.85.5611     Document Type: Article

References (7)

1. P. Hohenberg and W. Kohn, Phys. Rev. 136, B864 (1964).
2. W. Kohn and L. J. Sham, Phys. Rev. 140, A1122 (1965).
3. J. P. Perdew and M. Levy, Phys. Rev. Lett. 51, 1884 (1983); L. J. Sham and M. Schlüter, Phys. Rev. Lett. 51, 1888 (1983); R. W. Godby, M. Schlüter, and L. J. Sham, Phys. Rev. Lett. 56, 2415 (1986).
4. J. P. Perdew and M. Levy, Phys. Rev. Lett. 51, 1884 (1983); L. J. Sham and M. Schlüter, Phys. Rev. Lett. 51, 1888 (1983); R. W. Godby, M. Schlüter, and L. J. Sham, Phys. Rev. Lett. 56, 2415 (1986).
5. J. P. Perdew and M. Levy, Phys. Rev. Lett. 51, 1884 (1983); L. J. Sham and M. Schlüter, Phys. Rev. Lett. 51, 1888 (1983); R. W. Godby, M. Schlüter, and L. J. Sham, Phys. Rev. Lett. 56, 2415 (1986).
6. X. Gonze, P. Ghosez, and R. W. Godby, Phys. Rev. Lett. 74, 4035 (1995); P. Ghosez, X. Gonze, and R. W. Godby, Phys. Rev. B 56, 12811 (1997).
7. X. Gonze, P. Ghosez, and R. W. Godby, Phys. Rev. Lett. 74, 4035 (1995); P. Ghosez, X. Gonze, and R. W. Godby, Phys. Rev. B 56, 12811 (1997).