Ab initio molecular dynamics simulations

Journal of Physical Chemistry

Volumn 100, Issue 31, 1996, Pages 12878-12887

  Tuckerman, Mark E ^a   Ungar, P Jeffrey ^a   Von Rosenvinge, Tycho ^a   Klein, Michael L ^a  

^a UNIVERSITY OF PENNSYLVANIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

PHOSPHORUS; PHYSICAL CHEMISTRY; SIMULATION;

AB INITIO CALCULATIONS; CLUSTERS; CONDENSED PHASE MOLECULAR SYSTEMS; HYDROGEN CHLORIDE; IONIC SOLVATION; MOLECULAR CRYSTALS; NITROMETHANE; NUCLEAR MOTIONS; PROTON TRANSPORT; WHITE PHOSPHORUS;

MOLECULAR DYNAMICS;

EID: 0030218763     PISSN: 00223654     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp960480+     Document Type: Article

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