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Volumn 439, Issue , 2014, Pages 63-70

Construction of global ab initio potential energy surfaces for the HNS system and quantum dynamics calculations for the S(3P) + NH(X 3Σ) → NS(X2Π) + H(2S) and N( 4S) + SH(X2Π) → NS(X2Π) + H( 2S) reactions

Author keywords

Ab initio calculation; Interstellar chemistry; Nitrogen sulfide; Potential energy surface; Quantum reactive scattering; Reaction dynamics

Indexed keywords


EID: 84902316393     PISSN: 03010104     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.chemphys.2014.05.009     Document Type: Article
Times cited : (7)

References (44)
  • 20
    • 77954219446 scopus 로고    scopus 로고
    • MOLPRO is a package of ab initio programs written by H.-J. Werner, P.J. Knowles, G. Knizia, F.R. Manby, M. Schütz, P. Celani, T. Korona, R. Lindh, A. Mitrushenkov, G. Rauhut, K.R. Shamasundar, T.B. Adler, R.D. Amos, A. Bernhardsson, A. Berning, D.L. Cooper, M.J.O. Deegan, A.J. Dobbyn, F. Eckert, E. Goll, C. Hampel, A. Hesselmann, G. Hetzer, T. Hrenar, G. Jansen, C. Köppl, Y. Liu, A.W. Lloyd, R.A. Mata, A.J. May, S.J. McNicholas, W. Meyer, M.E. Mura, A. Nicklaß, D.P. O'Neill, P. Palmieri, D. Peng, K. Pflüger, R. Pitzer, M. Reiher, T. Shiozaki, H. Stoll, A.J. Stone, R. Tarroni, T. Thorsteinsson, M. Wang, see < http://www.molpro.net >.
    • MOLPRO Is A Package of Ab Initio Programs Written
    • Werner, H.-J.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.