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Volumn 814, Issue 1-3, 2007, Pages 25-32

DFT calculations of the local spin densities and oligomerization mechanism of thiophene-phenylene (TP) co-oligomers and derivatives

Author keywords

Conjugated polymers; DFT; Local spin densities; Thiophene phenylene

Indexed keywords


EID: 34249292938     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2007.02.043     Document Type: Article
Times cited : (19)

References (33)
  • 1
    • 0003714767 scopus 로고
    • Skotheim T.A. (Ed), Marcel Dekker, New York
    • In: Skotheim T.A. (Ed). Handbook of Conducting Polymers (1986), Marcel Dekker, New York
    • (1986) Handbook of Conducting Polymers
  • 2
    • 34249307842 scopus 로고    scopus 로고
    • Advances in Synthetic Materials, Twenty Years of progress in Sciences and Technology, Edité par Bernier, Lefrant et Bidan, Elsevier (1995); Special issues on molecular materials for electronic and optoelectronic devices Acc. Chem. Res., 32 (1999) 191.
  • 3
    • 4243893235 scopus 로고    scopus 로고
    • J. Roncali, Chem. Rev., 92 (1992) 711; P.C. Lacacze, S. Aeiyach, J.C. Lacroix, in: H.S. Nalwa (Ed.), Handbook of Organic Conductive Molecules and Polymers: Conductive Polymers: Synthesis's and Electrical Properties Poly(p-phenyl): Preparation Techniques and Properties, Université Denis Diderot Paris VII, Paris, France, vol. 2, Wiley, London, 1997 (Chapter 6).
  • 22
    • 34249337145 scopus 로고    scopus 로고
    • M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, V.G. Zakrzewski, J.A. Montgomery, R.E. Stratmann, J.R. Burant, S. Dapprich, J.M. Millam, A.D. Daniels, K.N. Kudin, M.C. Strain, O. Farkas, J. Tomasi, V. Barone, M. Cossi, R. Cammi, B. Mennucci, C. Promelli, C. Adamo, S. Clifford, J. Ocherski, A. Petersson, P.Y. Ayala, Q. Cui, K. Morokuma, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J. Cioslowski, J.V. Ortiz, B.B Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R. Gomperts, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, C. Gonzalez, M. Challacombe, P.M.W. Gill, B.G. Johnson, W.Chen, M.W. Wong, J.L. Andres, M. Head-Gordon, E.S. Replogle, J.A. Pople, gaussian98, Revision A 7, Gaussian Inc., Pittsburgh, PA, 2003.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.