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Volumn 119, Issue 41, 1997, Pages 9891-9896

Importance of quantum effects for C-H bond activation reactions

Author keywords

[No Author keywords available]

Indexed keywords

RHODIUM COMPLEX;

EID: 0030663480     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja972209r     Document Type: Article
Times cited : (55)

References (122)
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    • Moser, W. R., Slocum, D. W., Eds.; American Chemical Society: Washington, D.C.
    • Tanaka, M.; Sakakura, T. In Advances in Chemistry Series; Moser, W. R., Slocum, D. W., Eds.; American Chemical Society: Washington, D.C., 1992; Vol. 230, p 181.
    • (1992) Advances in Chemistry Series , vol.230 , pp. 181
    • Tanaka, M.1    Sakakura, T.2
  • 6
    • 0000893556 scopus 로고
    • Jones, W. D.; Feher, F. J. J. Am. Chem. Soc. 1982, 104, 4240; 1986, 108, 4814.
    • (1986) J. Am. Chem. Soc. , vol.108 , pp. 4814
  • 57
    • 36849104097 scopus 로고
    • max = 1, see: Marcus, R. A. J. Chem. Phys. 1966, 45, 4500. Equation 1 neglects rotation-vibration coupling, curvilinear effects on the harmonic frequencies, anharmonicity, and curvature-induced coupling of the generalized normal modes, all of which have been discussed elsewhere in the literature; see ref 28a and
    • (1966) J. Chem. Phys. , vol.45 , pp. 4500
    • Marcus, R.A.1
  • 63
    • 36449008542 scopus 로고
    • (h) Jackels, C. F.; Gu, Z.; Truhlar, D. G. J. Chem. Phys. 1995, 102, 3188. On the basis of these studies it seems unlikely that inclusion of these higher-order terms would change the conclusions of this paper.
    • (1995) J. Chem. Phys. , vol.102 , pp. 3188
    • Jackels, C.F.1    Gu, Z.2    Truhlar, D.G.3
  • 91
    • 24244446601 scopus 로고
    • (b) Hofacker, G. L.; Levine, R. D. Chem. Phys. Lett. 1973, 15, 165, 1975, 33, 404.
    • (1975) Chem. Phys. Lett. , vol.33 , pp. 404
  • 93
    • 1842295551 scopus 로고
    • Gross, R. F. W., Bott, J. F., Eds.; Wiley-Interscience: New York
    • (d) Ben-Shaul, A.; Hofacker, G. L. In Handbook of Chemical Lasers; Gross, R. F. W., Bott, J. F., Eds.; Wiley-Interscience: New York, 1976; p. 529.
    • (1976) Handbook of Chemical Lasers , pp. 529
    • Ben-Shaul, A.1    Hofacker, G.L.2
  • 100
    • 0001491435 scopus 로고    scopus 로고
    • (d) For a recent review of classical trajectory methods, including quasiclassical corrections, see: Sewell, T. D.; Thompson, D. L. Int. J. Mod. Phys. B 1997, 11, 1067.
    • (1997) Int. J. Mod. Phys. B , vol.11 , pp. 1067
    • Sewell, T.D.1    Thompson, D.L.2


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