Characterization of the glass transition of water predicted by molecular dynamics simulations using nonpolarizable intermolecular potentials

Journal of Physical Chemistry B

Volumn 118, Issue 7, 2014, Pages 1867-1880

  Kreck, Cara A ^a   Mancera, Ricardo L ^a  

^a CURTIN UNIVERSITY   (Australia)

Author keywords

[No Author keywords available]

Indexed keywords

GLASS TRANSITION; HYDROGEN BONDS; MOLECULAR DYNAMICS; SPECIFIC HEAT;

CLASSICAL MOLECULAR DYNAMICS; COMPUTATIONAL COSTS; HOMOGENEOUS NUCLEATION TEMPERATURE; INTERMOLECULAR POTENTIALS; MINIMUM DENSITY; MOLECULAR DYNAMICS SIMULATIONS; SUPERCOOLED WATER; THERMAL EXPANSION COEFFICIENTS;

GLASS;

GLASS; WATER;

ARTICLE; CHEMISTRY; COMPARATIVE STUDY; HYDROGEN BOND; MOLECULAR DYNAMICS; PRESSURE; TEMPERATURE; THERMODYNAMICS; TRANSITION TEMPERATURE;

GLASS; HYDROGEN BONDING; MOLECULAR DYNAMICS SIMULATION; PRESSURE; TEMPERATURE; THERMODYNAMICS; TRANSITION TEMPERATURE; WATER;

EID: 84894527213     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp411716y     Document Type: Article

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