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Volumn 111, Issue 38, 2007, Pages 9355-9361

Insights into mechanistic photodissociation of acetyl chloride by ab initio calculations and molecular dynamics simulations

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; EXCITED STATES; MOLECULAR DYNAMICS; PHOTODISSOCIATION; POTENTIAL ENERGY SURFACES;

EID: 35148897380     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp073875+     Document Type: Article
Times cited : (12)

References (52)
  • 17
    • 0347468678 scopus 로고    scopus 로고
    • N. Kogure, N.; Ono, T.; Suzuki, E.; Watari, F. J. Mol. Struct. 1993, 296, 1-4.
    • N. Kogure, N.; Ono, T.; Suzuki, E.; Watari, F. J. Mol. Struct. 1993, 296, 1-4.
  • 34
    • 35148868399 scopus 로고    scopus 로고
    • Gaussian, Inc, Pittsburgh, PA
    • Frisch, M. J. et al. Gaussian 98, Gaussian, Inc.: Pittsburgh, PA 1998.
    • (1998) Gaussian , vol.98
    • Frisch, M.J.1
  • 35
    • 35148871937 scopus 로고    scopus 로고
    • MOLPRO is a package of ab initio programs written by Werner, H.-J, et al
    • MOLPRO is a package of ab initio programs written by Werner, H.-J., et al.
  • 37
    • 33644560057 scopus 로고    scopus 로고
    • Allinger, N. L, Kollman, P. A, Clark, T, Schaefer, H. F, III, Gasteiger, J, Schreiner, P. R, Eds, Wiley: Chichester, U.K
    • Thompson, D. L., In Encyclopedia of Computational Chemistry; Schleyer, P. v. R., Allinger, N. L., Kollman, P. A., Clark, T.; Schaefer, H. F., III, Gasteiger, J., Schreiner, P. R., Eds.; Wiley: Chichester, U.K., 1998; p 3506.
    • (1998) Encyclopedia of Computational Chemistry; Schleyer, P , vol.R , pp. 3506
    • Thompson, D.L.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.