An ab initio study of the vibrational spectra of Li-doped thiophene, bithiophene, benzene and biphenyl as model systems for (bi)polaronic defects

Journal of Molecular Structure: THEOCHEM

Volumn 364, Issue 1, 1996, Pages 15-31

  Irle, Stephan ^a   Lischka, Hans ^a  

^a UNIVERSITY OF VIENNA   (Austria)

Author keywords

Ab initio calculation; Bipolaron; Charge transfer complex; Polaron; Scaled force field; Vibrational spectra

Indexed keywords

EID: 0003069194     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/0166-1280(95)04465-5     Document Type: Article

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