Modeling equilibrium concentrations of Bjerrum and molecular point defects and their complexes in ice Ih

Journal of Chemical Physics

Volumn 128, Issue 16, 2008, Pages

  De Koning, Maurice ^a   Antonelli, Alex ^a  

^a UNIVERSITY OF CAMPINAS   (Brazil)

Author keywords

[No Author keywords available]

Indexed keywords

BINDING ENERGY; DENSITY FUNCTIONAL THEORY; ICE; MOLECULAR MODELING; THERMAL EFFECTS;

INTERSTITIAL COMPLEXES; MODELING EQUILIBRIUM CONCENTRATIONS; THERMAL EQUILIBRIUM;

POINT DEFECTS;

EID: 42949126318     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2902280     Document Type: Article

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