Three-dimensional structure and hydrogen bonding of water in sub- and supercritical regions: a molecular simulation study

Journal of Supercritical Fluids

Volumn 13, Issue 1-3, 1998, Pages 83-91

  Chin Liew, Chee ^a   Inomata, Hiroshi ^a   Arai, Kunio ^a   Saito, Shozaburo ^a  

^a TOHOKU UNIVERSITY   (Japan)

Author keywords

Hydrogen bonding; Molecular simulation; Supercritical water; Three dimensional structure

Indexed keywords

AQUEOUS SOLUTIONS; BIFURCATED HYDROGEN BONDING; CRITICAL REGION; FLEXIBLE MODEL; HYDROGEN BONDINGS; MD SIMULATION; MOLECULAR DYNAMICS SIMULATIONS; MOLECULAR SIMULATIONS; PURE WATER; PVT BEHAVIOR; SELF-DIFFUSION OF WATER; SPATIAL DISTRIBUTION FUNCTIONS; SUPERCRITICAL REGIONS; SUPERCRITICAL WATER; THREE-DIMENSIONAL SOLUTIONS; THREE-DIMENSIONAL STRUCTURE;

DISTRIBUTION FUNCTIONS; FUZZY CONTROL; HYDROGEN; LIGHT MEASUREMENT; MOLECULAR DYNAMICS; MOLECULAR STRUCTURE; REACTION KINETICS; THREE DIMENSIONAL;

HYDROGEN BONDS;

EID: 77953573857     PISSN: 08968446     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0896-8446(98)00038-2     Document Type: Article

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