The phase diagram of water at negative pressures: Virtual ices

Journal of Chemical Physics

Volumn 131, Issue 3, 2009, Pages

  Conde, M M ^a   Vega, C ^a   Tribello, G A ^b,c   Slater, B ^b  

^a UNIVERSIDAD COMPLUTENSE DE MADRID   (Spain)

^b UNIVERSITY COLLEGE LONDON   (United Kingdom)

^c ETH ZURICH   (Switzerland)

Author keywords

[No Author keywords available]

Indexed keywords

DENSITY FUNCTIONAL THEORY CALCULATIONS; FREE-ENERGY CALCULATIONS; GIBBS-DUHEM INTEGRATION; HYDRATE STRUCTURES; ICE STRUCTURES; LOWER DENSITY; NEGATIVE PRESSURES; RELATIVE STABILITIES; SOLID STRUCTURES; STABLE PHASE; STABLE SOLID PHASIS; WATER POTENTIAL;

FREE ENERGY; HYDRATES; HYDRATION; ICE; PHASE DIAGRAMS; PRESSURE DISTRIBUTION;

DENSITY FUNCTIONAL THEORY;

ICE; WATER;

ARTICLE; CHEMICAL MODEL; CHEMISTRY; COMPUTER SIMULATION; PRESSURE; TEMPERATURE;

COMPUTER SIMULATION; ICE; MODELS, CHEMICAL; PRESSURE; TEMPERATURE; WATER;

EID: 67651152968     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3182727     Document Type: Article

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