Ab initio calculations of Raman intensity parameters and geometry of polyynes and polyynenitriles

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 53, Issue 12, 1997, Pages 2053-2059

  Dudev, Todor ^a   Galabov, Boris ^a  

^a UNIVERSITY OF SOFIA   (Bulgaria)

Author keywords

Ab initio calculations; Ab initio molecular geometries and polarizabilities; Atomic polarizability tensors; Effective induced bond charges; Polyynes and polyynenitriles; Raman intensities

Indexed keywords

EID: 0040569511     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/S1386-1425(97)00122-4     Document Type: Article

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