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Volumn 856, Issue 1-3, 2008, Pages 16-29

A theoretical study of H(S2N2)YH (Y = 1, 2, 3, 4, 5): Modeling the superconducting polymer (SN)X

Author keywords

Conductivity; Density functional theory; Effective exchange model; Mixed valence model; Polysulfurnitride; Superconductivity

Indexed keywords


EID: 41949109649     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2008.01.008     Document Type: Article
Times cited : (10)

References (66)
  • 14
    • 41949099715 scopus 로고    scopus 로고
    • 108, Oxford, Clarendon, 1955.
    • 108, Oxford, Clarendon, 1955.
  • 15
    • 41949115997 scopus 로고    scopus 로고
    • Electron Transfer-from Isolated Molecules to Biomolecules, Pt. 1, 1, John Wiley & Sons Inc., New York, 1999.
    • Electron Transfer-from Isolated Molecules to Biomolecules, Pt. 1, 1, John Wiley & Sons Inc., New York, 1999.
  • 26
    • 41949088754 scopus 로고    scopus 로고
    • note
    • M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, V.G. Zakrzewski, J.J.A. Montgomery, R.E. Stratmann, J.C. 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. Pomelli, C. Adamo, S. Clifford, J. Ochterski, G.A. Petersson, P.Y. Ayala, Q. Cui, K. Morokuma, N. Rega, P. Salvador, J.J. Dannenberg, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J. Cioslowski, J.V. Ortiz, A.G. Baboul, 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, M. Challacombe, P.M. W. Gill, B. Johnson, W. Chen, M.W. Wong, J.L. Andres, C. Gonzalez, M. Head-Gordon, E.S. Replogle, J.A. Pople, Gaussian 98, Revision A.11.4, Gaussian, Inc., Pittsburgh, PA, 2002
  • 33
    • 41949086856 scopus 로고    scopus 로고
    • R.C. Mawhinney, A Statistical Assessment of Quantum Chemical Procedures and a Study of Compounds Containing Sulfur and Nitrogen, Ph.D., 2002.
    • R.C. Mawhinney, A Statistical Assessment of Quantum Chemical Procedures and a Study of Compounds Containing Sulfur and Nitrogen, Ph.D., 2002.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.