Instantaneous normal mode analysis of orientational motions in liquid water: Local structural effects

Journal of Chemical Physics

Volumn 121, Issue 8, 2004, Pages 3605-3612

  Chang, S L ^a,c   Wu, Ten Ming ^a   Mou, Chung Yuan ^b  

^a NATIONAL CHIAO TUNG UNIVERSITY   (Taiwan)

^b NATIONAL TAIWAN UNIVERSITY   (Taiwan)

^c NATIONAL PENGHU UNIVERSITY OF SCIENCE AND TECHNOLOGY   (Taiwan)

Author keywords

[No Author keywords available]

Indexed keywords

BONDING; BOUNDARY CONDITIONS; COMPUTER SIMULATION; DIFFUSION; HYDROGEN BONDS; MATHEMATICAL OPERATORS; MATRIX ALGEBRA; MOLECULAR DYNAMICS; MOLECULAR VIBRATIONS; OXYGEN; POTENTIAL ENERGY; RATE CONSTANTS; RELAXATION PROCESSES; ROTATION;

COULOMB INTERACTIONS; DENSITY OF STATES (DOS); INSTANTANEOUS NORMAL MODES (INM); VORONOI POLYHEDRA (VP);

WATER;

EID: 4444222909     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1772759     Document Type: Article

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