Ab initio HF and DFT calculations of geometric structures and vibrational spectra of electrically conducting doped oligothiophenes

Journal of Molecular Structure: THEOCHEM

Volumn 463, Issue 1-2, 1999, Pages 211-216

  Casado, J ^a   Hernandez V ^a   Ramirez F J ^a   Lopez Navarrete J T ^a  

^a UNIVERSITY OF MÁLAGA   (Spain)

Author keywords

DFT; Oligothiophenes; Vibrational spectra

Indexed keywords

CATION; THIOPHENE DERIVATIVE;

ARTICLE; CALCULATION; CHEMICAL STRUCTURE; CONTROLLED STUDY; ELECTRIC CONDUCTIVITY; ELECTRICITY; GEOMETRY; INFRARED RADIATION; IONIZATION; THEORY; VIBRATION;

EID: 0033597053     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(98)00416-3     Document Type: Article

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