Ab initio calculation of forces and lattice relaxations in metallic alloys

Philosophical Magazine B: Physics of Condensed Matter; Statistical Mechanics, Electronic, Optical and Magnetic Properties

Volumn 78, Issue 5-6, 1998, Pages 429-433

  Korhonen, T ^a   Papanikolaou, N ^a   Zeller, R ^a   Dederichs, P H ^a  

^a FORSCHUNGSZENTRUM JÜLICH   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; CRYSTAL DEFECTS; CRYSTAL IMPURITIES; ELECTRON ENERGY LEVELS; ELECTRON TRANSITIONS; ELECTRONIC STRUCTURE; GREEN'S FUNCTION; LATTICE CONSTANTS; LATTICE VIBRATIONS; POTENTIAL ENERGY; RELAXATION PROCESSES; SOLID STATE PHYSICS;

CHARGE DENSITY; KORRINGA-KOHN-ROSTOKER (KKR) METHOD; LATTICE RELAXATION; LATTICE STATICS; LOCAL SPIN DENSITY APPROXIMATION;

IRON ALLOYS;

EID: 0032206264     PISSN: 13642812     EISSN: None     Source Type: Journal    
DOI: 10.1080/13642819808206741     Document Type: Article

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