메뉴 건너뛰기




Volumn 4, Issue 12, 2008, Pages 2101-2107

Covalent excited states of polyenes CH(n=2#8) and polyenyl radicals CH(n=2#8): An ab initio valence bond study

Author keywords

[No Author keywords available]

Indexed keywords


EID: 58149229520     PISSN: 15499618     EISSN: None     Source Type: Journal    
DOI: 10.1021/ct800341z     Document Type: Article
Times cited : (18)

References (75)
  • 4
    • 0002192623 scopus 로고
    • Lim, E. C, Ed, Academic Press: New York
    • Hudson, B. S.; Kohler, B. E.; Schulten, K. Excited States; Lim, E. C., Ed.; Academic Press: New York, 1982; Vol. 6, pp 1-95.
    • (1982) Excited States , vol.6 , pp. 1-95
    • Hudson, B.S.1    Kohler, B.E.2    Schulten, K.3
  • 7
    • 0342662055 scopus 로고    scopus 로고
    • Contribution of Quantum Chemistry to the Study of Dienes and Polyenes
    • Rappoport, Z, Ed, John Wiley & Sons: Chichester
    • Branchadell, V.; Sodupe, M.; Oliva, A.; Bertrán, J. Contribution of Quantum Chemistry to the Study of Dienes and Polyenes. In The Chemistry of Dienes and Polyenes; Rappoport, Z., Ed.; John Wiley & Sons: Chichester, 1997; Vol. 1, pp 1-23.
    • (1997) The Chemistry of Dienes and Polyenes , vol.1 , pp. 1-23
    • Branchadell, V.1    Sodupe, M.2    Oliva, A.3    Bertrán, J.4
  • 41
    • 0036930818 scopus 로고    scopus 로고
    • Schmalz, T. G. Valence Bond Theory: A Valence Bond View of Fullerenes. In Theoretical and Computational Chemistry; Cooper, D. L., Ed.; Elsevier: Amsterdam, 2002; 10, pp 535.
    • Schmalz, T. G. Valence Bond Theory: A Valence Bond View of Fullerenes. In Theoretical and Computational Chemistry; Cooper, D. L., Ed.; Elsevier: Amsterdam, 2002; Vol. 10, pp 535.
  • 42
    • 0036930359 scopus 로고    scopus 로고
    • Valence Bond Theory: Resonating Valence-Bond Theories for Carbon p-Networks and Classical/Quantum Connections
    • Cooper, D. L, Ed, Elsevier: Amsterdam
    • Klein, D. J. Valence Bond Theory: Resonating Valence-Bond Theories for Carbon p-Networks and Classical/Quantum Connections. In Theoretical and Computational Chemistry; Cooper, D. L., Ed.; Elsevier: Amsterdam, 2002; Vol. 10, p 447.
    • (2002) Theoretical and Computational Chemistry , vol.10 , pp. 447
    • Klein, D.J.1
  • 47
    • 0004284191 scopus 로고    scopus 로고
    • Elsevier: Amsterdam, The Netherlands
    • Cooper, D. L. Valence Bond Theory; Elsevier: Amsterdam, The Netherlands, 2002.
    • (2002) Valence Bond Theory
    • Cooper, D.L.1
  • 49
    • 58149221217 scopus 로고    scopus 로고
    • A special issue on 90 Years of the Lewis concept: J. Comput. Chem. 2007, 28.
    • A special issue on 90 Years of the Lewis concept: J. Comput. Chem. 2007, 28.
  • 56
    • 0036929845 scopus 로고    scopus 로고
    • Zhang, Q. A Spin-Free Approach for Valence Bond Theory and Its Application
    • Cooper, D. L, Ed, Elsevier: Amsterdam
    • Wu, W.; Mo, Y.; Cao, Z.: Zhang, Q. A Spin-Free Approach for Valence Bond Theory and Its Application. In Valence Bond Theory; Cooper, D. L., Ed.; Elsevier: Amsterdam, 2002; pp 143-185.
    • (2002) Valence Bond Theory , pp. 143-185
    • Wu, W.1    Mo, Y.2    Cao, Z.3
  • 64
    • 58149225141 scopus 로고    scopus 로고
    • Song, L.; Wu, W.; Mo, Y.; Zhang, Q. XMVB: An Ah Initio Nonorthogonal Valence Bond Program; Xiamen University:Xiamen, 1999.
    • (a) Song, L.; Wu, W.; Mo, Y.; Zhang, Q. XMVB: An Ah Initio Nonorthogonal Valence Bond Program; Xiamen University:Xiamen, 1999.
  • 66
    • 58149222525 scopus 로고    scopus 로고
    • MOLPRO (version 98.1) is a package of ab initio programs written by Werner, H.-J. and Knowles, P. J. with contributions from Almlöf, J, Amos, R. D, Berning, A, Cooper, D. L, Deegan, M. J. O, Dobbyn, A. J, Eckert, F, Elbert, S. T, Hampel, C, Lindh, R, Lloyd, A. W, Meyer, W, Nicklass, A, Peterson, K, Pitzer, R, Stone, A. J, Taylor, P. R, Mura, M. E, Pulay, P, Schü tz, M, Stoll, H, Thorsteinsson, T
    • MOLPRO (version 98.1) is a package of ab initio programs written by Werner, H.-J. and Knowles, P. J. with contributions from Almlöf, J.; Amos, R. D.; Berning, A.; Cooper, D. L.; Deegan, M. J. O.; Dobbyn, A. J.; Eckert, F.; Elbert, S. T.; Hampel, C.; Lindh, R.; Lloyd, A. W.; Meyer, W.; Nicklass, A.; Peterson, K.; Pitzer, R.; Stone, A. J.; Taylor, P. R.; Mura, M. E.; Pulay, P.; Schü tz, M.; Stoll, H.; Thorsteinsson, T.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.