Materials simulations using VASP-a quantum perspective to materials science

Computer Physics Communications

Volumn 177, Issue 1-2 SPEC. ISS., 2007, Pages 6-13

  Hafner, J ^a  

^a UNIVERSITY OF VIENNA   (Austria)

Author keywords

Catalysis; Density functional theory; Intermetallics; Magnetism; Materials science; Post DFT approaches; Quasicrystals; Surface science

Indexed keywords

CATALYSIS; COMPUTER SIMULATION; DENSITY FUNCTIONAL THEORY; INTERMETALLICS; MAGNETISM; MATERIALS PROPERTIES; NANOSTRUCTURED MATERIALS; QUASICRYSTALS;

POST-DFT APPROACHES; QUANTUM PERSPECTIVE; SURFACE SCIENCE;

MATERIALS SCIENCE;

EID: 34250656999     PISSN: 00104655     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cpc.2007.02.045     Document Type: Article

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