메뉴 건너뛰기




Volumn 48, Issue 8, 2009, Pages 3591-3607

Low-energy bands of ferrocene-ferrocenium dimers: Bandshape analysis with a four-level two-mode vibronic coupling configuration interaction (VCCI) model including asymmetry

Author keywords

[No Author keywords available]

Indexed keywords

FERROCENE; FERROCENIUM; FERROUS ION;

EID: 65349181485     PISSN: 00201669     EISSN: None     Source Type: Journal    
DOI: 10.1021/ic802112h     Document Type: Article
Times cited : (12)

References (58)
  • 3
    • 0003486442 scopus 로고    scopus 로고
    • Kuznetsov, A, Ulstrup, J, Eds, Wiley-VCH: New York
    • (c) Electron Transfer in Chemistry and Biology; Kuznetsov, A., Ulstrup, J., Eds.; Wiley-VCH: New York, 1998.
    • (1998) Electron Transfer in Chemistry and Biology
  • 24
    • 0014591040 scopus 로고    scopus 로고
    • In the case of a class III dimer, there is no net charge transfer, and the term intervalence charge transfer transition for the low-energy electronic transition within the symmetric/antisymmetric pair of MOs containing the SOMO of a radical is, strictly speaking, wrong. Badger and Brocklehurst had proposed the term charge resonance band some time ago for such a transition: Badger, B, Brocklehurst, B. Trans. Faraday Soc. 1969, 2576
    • In the case of a class III dimer, there is no net charge transfer, and the term "intervalence charge transfer transition" for the low-energy electronic transition within the symmetric/antisymmetric pair of MOs containing the SOMO of a radical is, strictly speaking, wrong. Badger and Brocklehurst had proposed the term "charge resonance" band some time ago for such a transition: Badger, B.; Brocklehurst, B. Trans. Faraday Soc. 1969, 2576.
  • 25
    • 65349182807 scopus 로고    scopus 로고
    • Schatz, P. N. In Inorganic Electronic Structure and Spectroscopy, II: Applications and Case Studies; Solomon, E. I., Lever, A. B. B., Eds.; John Wiley & Sons: New York, 1990; S. 175.
    • Schatz, P. N. In Inorganic Electronic Structure and Spectroscopy, Volume II: Applications and Case Studies; Solomon, E. I., Lever, A. B. B., Eds.; John Wiley & Sons: New York, 1990; S. 175.
  • 35
    • 0003740824 scopus 로고
    • Vibronic Coupling Models for Mixed Valence Line Shapes: Going beyond the PKS Approach
    • Prassides, K, Ed, Kluver: Dordrecht, The Netherlands
    • Piepho, S. B. Vibronic Coupling Models for Mixed Valence Line Shapes: Going beyond the PKS Approach. In Mixed Valency Systems: Applications in Chemistry, Physics and Biology; Prassides, K., Ed.; Kluver: Dordrecht, The Netherlands, 1991; p 329.
    • (1991) Mixed Valency Systems: Applications in Chemistry, Physics and Biology , pp. 329
    • Piepho, S.B.1
  • 37
    • 65349134530 scopus 로고    scopus 로고
    • Modifications of the original Gasyna and Schatz programs referenced in ref 21 were used.
    • Modifications of the original Gasyna and Schatz programs referenced in ref 21 were used.
  • 39
    • 0042530452 scopus 로고    scopus 로고
    • Viel, A.; Krawczyk, R. P.; Manthe, U.; Domcke, W. Angew. Chem., Int. Ed. 2003, 42, 3434 and refs cited therein; (b) Bonačić-Koutecký, V.; Č ižek, J.; Döhnert, D.; Koutecký, J. J. Chem. Phys. 1978, 69, 1168.
    • (a) Viel, A.; Krawczyk, R. P.; Manthe, U.; Domcke, W. Angew. Chem., Int. Ed. 2003, 42, 3434 and refs cited therein; (b) Bonačić-Koutecký, V.; Č ižek, J.; Döhnert, D.; Koutecký, J. J. Chem. Phys. 1978, 69, 1168.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.