Ab initio mass tensor molecular dynamics

Journal of Chemical Physics

Volumn 134, Issue 4, 2011, Pages

  Tsuchida, Eiji ^a  

^a NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY AIST   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO; AB INITIO MOLECULAR DYNAMICS SIMULATION; ATOMIC MASS; COMPUTATIONAL EFFORT; COMPUTATIONAL OVERHEADS; EFFICIENT SAMPLING; FIRST DERIVATIVE; LIQUID WATER; MOLECULAR DYNAMICS METHODS; PHASE SPACES;

COMPUTATIONAL CHEMISTRY; COMPUTATIONAL GEOMETRY; PHASE SPACE METHODS; TENSORS;

MOLECULAR DYNAMICS;

EID: 79551585811     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3543898     Document Type: Article

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