A new concise expression for the free energy of a reaction coordinate

Journal of Chemical Physics

Volumn 118, Issue 5, 2003, Pages 2057-2060

  Schlitter, Jürgen ^a   Klähn, Marco ^a  

^a RUHR UNIVERSITY BOCHUM   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

CALCULATIONS; CHEMICAL REACTIONS; COMPUTER SIMULATION; CONSTRAINT THEORY; DIFFERENTIAL EQUATIONS; HAMILTONIANS; INTEGRAL EQUATIONS; MATHEMATICAL TRANSFORMATIONS; MATRIX ALGEBRA; PHASE TRANSITIONS; PROBABILITY DENSITY FUNCTION;

ASSOCIATED FREE ENERGY PROFILE; POTENTIAL OF MEAN CONSTRAINT FORCE; REACTION COORDINATE;

MOLECULAR PHYSICS;

EID: 0037329606     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1534578     Document Type: Article

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