Efficient thermal rate constant calculation for rare event systems

Journal of Chemical Physics

Volumn 118, Issue 3, 2003, Pages 1085-1088

  Corcelli, S A ^a   Rahman, J A ^a   Tully, J C ^a  

^a YALE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CALCULATIONS; COMPUTER SIMULATION; ELECTRON ENERGY LEVELS; ISOMERIZATION; MATHEMATICAL MODELS; MONTE CARLO METHODS; PROBABILITY DISTRIBUTIONS; QUANTUM THEORY; RANDOM PROCESSES; RATE CONSTANTS;

POTENTIAL ENERGY SURFACE; RARE EVENT SYSTEM; THERMAL RATE CONSTANT;

MOLECULAR DYNAMICS;

EID: 0037439832     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1529192     Document Type: Article

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