Theoretical investigation on the oligothienoacenes under the influence of external electric field

Journal of Physics and Chemistry of Solids

Volumn 69, Issue 11, 2008, Pages 2615-2621

  Ye, Yuanfeng ^a   Zhang, Milin ^a   Liu, Hongmei ^b   Liu, Xuewei ^c   Zhao, Jianwei ^b  

^a HARBIN ENGINEERING UNIVERSITY   (China)

^b NANJING UNIVERSITY   (China)

^c NANYANG TECHNOLOGICAL UNIVERSITY   (Singapore)

Author keywords

Ab initio calculations; Electronic materials; Electronic structure

Indexed keywords

CALCULATIONS; ELECTRONIC STRUCTURE; MOLECULAR ORBITALS;

AB INITIO CALCULATIONS; CARBON-CARBON DOUBLE BONDS; CARBON-CARBON SINGLE BONDS; ELECTRONIC MATERIALS; EXTERNAL ELECTRIC FIELD; HIGHEST OCCUPIED MOLECULAR ORBITAL; LOWEST UNOCCUPIED MOLECULAR ORBITAL; THEORETICAL INVESTIGATIONS;

ELECTRIC FIELDS;

EID: 55349083305     PISSN: 00223697     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jpcs.2008.06.005     Document Type: Article

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