메뉴 건너뛰기




Volumn 104, Issue 23, 1996, Pages 9445-9460

Comparison of zero-point energy constrained and quantum anharmonic Rice-Ramsperger-Kassel-Marcus and phase space theory rate constants for Al3 dissociation

Author keywords

[No Author keywords available]

Indexed keywords


EID: 0000513415     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.471704     Document Type: Review
Times cited : (21)

References (156)
  • 32
  • 83
    • 0003847964 scopus 로고
    • edited by M. N. R. Ashfold and J. E. Baggot Royal Society of Chemistry, London
    • W. L. Hase and D. M. Wardlaw, in Bimolecular Collisions, edited by M. N. R. Ashfold and J. E. Baggot (Royal Society of Chemistry, London, 1989).
    • (1989) Bimolecular Collisions
    • Hase, W.L.1    Wardlaw, D.M.2
  • 111
    • 85033053016 scopus 로고    scopus 로고
    • note
    • The Pitzer-Gwinn expression, for approximating the quantum mechanical correction to a classical enharmonic partition function using their harmonic counterparts, is rigorously derived in Ref. 72.
  • 118
    • 0004067962 scopus 로고
    • edited by W. H. Miller Plenum, New York
    • W. L. Hase, in Dynamics of Molecular Collisions B, edited by W. H. Miller (Plenum, New York, 1976), and references therein.
    • (1976) Dynamics of Molecular Collisions B
    • Hase, W.L.1
  • 136
    • 0000153863 scopus 로고
    • VENUS is an enhanced version of MERCURY; W. L. Hase, QCPE 3, 453 (1983).
    • (1983) QCPE , vol.3 , pp. 453
    • Hase, W.L.1
  • 145
    • 85033058539 scopus 로고    scopus 로고
    • note
    • In previous ZPE constrained trajectory studies of triatomic dissociation (Ref. 78), the ZPE constraint was only applied to the high frequency mode; i.e., the diatom stretch mode in the product region.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.