Structure determination of the 4d metal diborides: A quantum mechanical study

Journal of Physical Chemistry B

Volumn 110, Issue 11, 2006, Pages 5367-5371

  Pallas, Anna ^a   Larsson, Karin ^a  

^a UPPSALA UNIVERSITY   (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

BOUNDARY CONDITIONS; ELECTRON TRANSITIONS; MOLECULAR STRUCTURE; PROBABILITY DENSITY FUNCTION; QUANTUM THEORY;

DENSITY FUNCTIONAL THEORY (DFT); ENERGETIC STABILITY; METAL DIBORIDES;

BORON COMPOUNDS;

EID: 33645672103     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp056652x     Document Type: Article

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