Fully local orbital-free calculation of electronic structure using pseudopotentials

Physica B: Condensed Matter

Volumn 339, Issue 2-3, 2003, Pages 119-129

  Pino, Ramiro ^a,b   Markvoort, A J ^a   Van Santen, R A ^a   Hilbers, P A J ^a  

^a EINDHOVEN UNIVERSITY OF TECHNOLOGY   (Netherlands)

^b RICE UNIVERSITY   (United States)

Author keywords

Atomic and molecular clusters; Density functional theory; Molecular dynamics calculations; Statistical model calculations

Indexed keywords

ATOMIC PHYSICS; ELECTRONIC DENSITY OF STATES; ELECTROSTATICS; FERMI LEVEL; KINETIC ENERGY; MATHEMATICAL MODELS; PROBABILITY DENSITY FUNCTION; STATISTICAL METHODS;

PSEUDOPOTENTIALS;

ELECTRONIC STRUCTURE;

EID: 0242636550     PISSN: 09214526     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.physb.2003.08.121     Document Type: Article

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