Molecular orbital studies of vibrational frequencies

International Journal of Quantum Chemistry

Volumn 20, Issue 15 S, 1981, Pages 269-278

  Pople, J A ^a   Schlegel, H B ^a   Krishnan, R ^a   Defrees, D J ^a   Binkley, J S ^a   Frisch, M J ^a   Whiteside, R A ^a   Hout, R F ^b   Hehre, W J ^b  

^a CARNEGIE MELLON UNIVERSITY   (United States)

^b UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 84983920787     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.560200829     Document Type: Article

References (24)

1. Ab initiocalculation of force constants and equilibrium geometries in polyatomic molecules
2. Comparison of theab initioforce constants of ethane, ethylene and acetylene