Molecular dynamics simulations of reactions on metal surfaces: Rate constants for selected diatomic dissociation reactions

Surface Science

Volumn 385, Issue 1, 1997, Pages 77-86

  Gislason, Jason ^a   Sellers, Harrell ^a  

^a SOUTH DAKOTA STATE UNIVERSITY   (United States)

Author keywords

Models of surface kinetics; Molecular dynamics

Indexed keywords

CARBON; COMPUTATIONAL METHODS; COMPUTER SIMULATION; GOLD; MOLECULAR DYNAMICS; NICKEL; OXYGEN; PLATINUM; REACTION KINETICS; SILVER; SULFUR;

ARRHENIUS REACTION KINETICS; NORMALIZED BOND INDEX (NBI); POTENTIAL ENERGY FUNCTION; ZERO COVERAGE LIMIT;

DISSOCIATION;

EID: 0031212566     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0039-6028(97)00186-6     Document Type: Article

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