From molecules to solids with the DMol3 approach

Journal of Chemical Physics

Volumn 113, Issue 18, 2000, Pages 7756-7764

  Delley, B ^a  

^a PAUL SCHERRER INSTITUTE   (Switzerland)

Author keywords

[No Author keywords available]

Indexed keywords

BAND STRUCTURE; CARBON; ENTHALPY; SILICON; SOLIDS; SULFUR;

METALLIC SOLIDS; MOLECULAR ENTHALPIES;

MOLECULAR DYNAMICS;

EID: 0034319689     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1316015     Document Type: Article

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