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Volumn 105, Issue 14, 2001, Pages 3623-3632

CF2XCF2X and CF2XCF2· radicals (X = Cl, Br, I): Ab initio and DFT studies and comparison with experiments

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRON CORRELATION EFFECTS;

EID: 0035849257     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp004035x     Document Type: Article
Times cited : (39)

References (68)
  • 2
    • 0004032955 scopus 로고
    • John Wiley & Sons: New York
    • Kochi, J. K. Free Radicals; John Wiley & Sons: New York, 1973; Vol. II.
    • (1973) Free Radicals , vol.2
    • Kochi, J.K.1
  • 9
    • 0000775245 scopus 로고
    • Kochi, J. K., Ed.; John Wiley & Sons: New York, London, Sydney, Toronto
    • Skell, P. S.; Shea, K. J. Bridged Free Radicals; Kochi, J. K., Ed.; John Wiley & Sons: New York, London, Sydney, Toronto, 1973.
    • (1973) Bridged Free Radicals
    • Skell, P.S.1    Shea, K.J.2
  • 31
    • 33646107786 scopus 로고    scopus 로고
    • Schrödinger, Inc.: Portland, OR
    • Jaguar Jaguar, 3.0 ed.; Schrödinger, Inc.: Portland, OR, 1997.
    • (1997) Jaguar Jaguar, 3.0 Ed.
  • 34
    • 33646108032 scopus 로고    scopus 로고
    • Exponent, Exponents for d-polarization functions for I, Br, Cl are 0.226, 0.380 and 0.750, respectively
    • Exponent, Exponents for d-polarization functions for I, Br, Cl are 0.226, 0.380 and 0.750, respectively.
  • 35
    • 33646089804 scopus 로고    scopus 로고
    • unpublished results: Exponents and coefficients for C, F, Cl, Br, and I are presented in the Supporting Information
    • Rappe, A. K.; Goddard, W. A., III, unpublished results: Exponents and coefficients for C, F, Cl, Br, and I are presented in the Supporting Information.
    • Rappe, A.K.1    Goddard III, W.A.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.