Empirical variable-charge models for titanium oxides: A study in transferability

Physical Review B - Condensed Matter and Materials Physics

Volumn 69, Issue 14, 2004, Pages

  Thomas, B S ^a,b   Marks, N A ^b   Begg, B D ^a  

^a AUSTRALIAN NUCLEAR SCIENCE AND TECHNOLOGY ORGANISATION   (Australia)

^b UNIVERSITY OF SYDNEY   (Australia)

Author keywords

[No Author keywords available]

Indexed keywords

TITANIUM DIOXIDE; ZEOLITE;

ARTICLE; CHEMICAL BOND; CRYSTAL STRUCTURE; ELECTRICITY; IONIZATION; MATHEMATICAL MODEL; MOLECULAR DYNAMICS; SOLID STATE; TEMPERATURE;

EID: 45849155835     PISSN: 01631829     EISSN: None     Source Type: Journal    
DOI: 10.1103/PhysRevB.69.144122     Document Type: Article

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