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Volumn 114, Issue 2, 2010, Pages 765-777

Roaming radical kinetics in the decomposition of acetaldehyde

Author keywords

[No Author keywords available]

Indexed keywords

AB-INITIO ELECTRONIC STRUCTURE CALCULATIONS; BOND FISSIONS; BRANCHING RATIO; ELECTRONIC STRUCTURE CALCULATIONS; MASTER EQUATIONS; MOLECULAR CHANNELS; MOLECULAR DISSOCIATION; MULTI REFERENCE; RADICAL KINETICS; REDUCED-DIMENSIONAL; RIGID BODY; THEORETICAL FRAMEWORK; THERMAL DECOMPOSITIONS; TRANSITION STATE; TRANSITION STATE THEORIES;

EID: 75249094987     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp906919w     Document Type: Article
Times cited : (107)

References (69)
  • 22
    • 75249085776 scopus 로고    scopus 로고
    • private communication
    • Kable, S. H., private communication.
    • Kable, S.H.1
  • 27
    • 75249105973 scopus 로고    scopus 로고
    • private communication
    • Kiefer, J. H., private communication.
    • Kiefer, J.H.1
  • 43
    • 0000834277 scopus 로고
    • Su, T. J. Chem. Phys. 1988, 88, 4102, 5355.
    • (1988) J. Chem. Phys , vol.88 , Issue.4102 , pp. 5355
    • Su, T.1
  • 49
    • 75249088568 scopus 로고    scopus 로고
    • MOLPRO is a package of ab initio programs written by Werner, H.-J, Knowles, P. J. with contributions from. Almlof, 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, Schutz, M, Stoll, H, Thorsteinsson, T. The majority of calculations reported here were done with version 2006.1
    • MOLPRO is a package of ab initio programs written by Werner, H.-J.; Knowles, P. J. with contributions from. Almlof, 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.; Schutz, M.; Stoll, H.; Thorsteinsson, T. The majority of calculations reported here were done with version 2006.1.
  • 55
    • 75249099036 scopus 로고    scopus 로고
    • private communication of unpublished data using ATcT v. 1.35 C(A)TN v. 1.063
    • Ruscic, B. private communication of unpublished data using ATcT v. 1.35 C(A)TN v. 1.063.
    • Ruscic, B.1
  • 68
    • 75249098227 scopus 로고    scopus 로고
    • private communication
    • Bowman, J. M., private communication.
    • Bowman, J.M.1
  • 69
    • 75249087904 scopus 로고    scopus 로고
    • private communication
    • Kiefer, J. H., private communication.
    • Kiefer, J.H.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.