Instantaneous normal mode analysis of hydrated electron solvation dynamics

Journal of Chemical Physics

Volumn 114, Issue 8, 2001, Pages 3598-3611

  Yang, Chao Yie ^a   Wong, Kim F ^a   Skaf, Munir S ^a   Rossky, Peter J ^a  

^a UNIVERSITY OF TEXAS AT AUSTIN   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; EIGENVALUES AND EIGENFUNCTIONS; ELECTRON TRANSITIONS; ELECTRONIC DENSITY OF STATES; FREQUENCIES; GROUND STATE; HYDRATION; MOLECULAR DYNAMICS; NUMERICAL METHODS; QUANTUM THEORY; RELAXATION PROCESSES; SOLVENTS;

HYDRATED ELECTRON SOLVATION DYNAMICS; IMAGINARY FREQUENCIES; INSTANTANEOUS NORMAL MODE; QUANTUM CLASSICAL MOLECULAR DYNAMIC SIMULATIONS; SHORT TIME SOLVATION DYNAMICS;

ELECTRONS;

EID: 0035250262     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1343871     Document Type: Article

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