A B3LYP hybrid density functional theory study of structural properties, energies, and heats of formation for silicon-hydrogen compounds

Journal of Molecular Structure: THEOCHEM

Volumn 497, Issue 1-3, 2000, Pages 65-73

  Jursic, B S ^a  

^a UNIVERSITY OF NEW ORLEANS   (United States)

Author keywords

Ab initio; Density functional theory study; Heaf of formation; Silicon hydrogen; Silicon Silicon

Indexed keywords

HYDROGEN; SILICON DERIVATIVE;

ARTICLE; CALCULATION; CHEMICAL ANALYSIS; CHEMICAL STRUCTURE; DENSITY; ENERGY; THEORY;

EID: 0034143248     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(99)00197-9     Document Type: Article

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