Computation of bond dissociation energies of substituted methanes with density functional theory

Tetrahedron Letters

Volumn 37, Issue 36, 1996, Pages 6473-6474

  Jursic, Branko S ^a   Timberlake, Jack W ^b   Engel, Paul S ^a  

^a UNIVERSITY OF NEW ORLEANS   (United States)

^b RICE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ALKANE;

ARTICLE; COMPUTER SIMULATION; DRUG STRUCTURE; MOLECULAR DYNAMICS;

EID: 0030565563     PISSN: 00404039     EISSN: None     Source Type: Journal    
DOI: 10.1016/0040-4039(96)01422-0     Document Type: Article

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