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Volumn 941, Issue 1-3, 2010, Pages 22-29

A comparative ab initio study of torsion-inversion coupling in CH3NH2, CH3 OH2+ and CH3 CH2{radical dot}

Author keywords

Inversion; Potential energy; Torsion; Torsion inversion coupling

Indexed keywords


EID: 73749088429     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2009.10.033     Document Type: Article
Times cited : (9)

References (50)
  • 38
    • 73749084173 scopus 로고    scopus 로고
    • H.-J. Werner et al, MOLPRO, A Package of Ab Initio Program, Version 2006.1, 2006
    • H.-J. Werner et al., MOLPRO, A Package of Ab Initio Program, Version 2006.1, 2006.
  • 39
    • 73749086259 scopus 로고    scopus 로고
    • Gaussian, Inc, Wallingford, CT
    • M.J. Frisch et al., Gaussian 03, Revision C.02, Gaussian, Inc., Wallingford, CT, 2004.
    • (2004) Gaussian 03, Revision , Issue.C.02
    • Frisch, M.J.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.