Deductive molecular mechanics of sp3 carbon atom

International Journal of Quantum Chemistry

Volumn 96, Issue 2, 2004, Pages 175-184

  Tchougreeff A L ^a,b   Tokmachev, A M ^a,b  

^a KARPOV INSTITUTE OF PHYSICAL CHEMISTRY   (Russian Federation)

^b KELDYSH INSTITUTE OF APPLIED MATHEMATICS   (Russian Federation)

Author keywords

Antisymmetrized product of strictly localized geminals; Bending; Bonding; Deductive molecular mechanics; Off diagonal force fields; sp3 carbon atom

Indexed keywords

APPROXIMATION THEORY; CHEMICAL BONDS; ELECTRONIC DENSITY OF STATES; ELECTRONIC STRUCTURE; MATRIX ALGEBRA; METHANE; MOLECULAR STRUCTURE; STEREOCHEMISTRY;

ANTISYMMETRIZED PRODUCT OF STRICTLY LOCALIZED GEMINALS; DEDUCTIVE MOLECULAR MECHANICS; EMPIRICAL FORCE FIELDS; OFF-DIAGONAL FORCE FIELDS;

CARBON;

EID: 0345764875     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/qua.10618     Document Type: Article

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