메뉴 건너뛰기




Volumn 106, Issue 51, 2002, Pages 12324-12330

Molecular structures and electron affinities for the chlorine oxides ClOO, ClOOO, and ClO3 (C3v)

Author keywords

[No Author keywords available]

Indexed keywords

BINDING ENERGY; COMPLEXATION; DIFFUSION; DISSOCIATION; GROUND STATE; ISOMERS; MOLECULAR STRUCTURE; MOLECULAR VIBRATIONS; POTENTIAL ENERGY; PROBABILITY DENSITY FUNCTION; SURFACE PROPERTIES;

EID: 0037180877     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp020362o     Document Type: Article
Times cited : (17)

References (52)
  • 31
    • 0012521839 scopus 로고
    • note
    • The BHandHLYP method implemented in the Gaussian programs has the formula 0.5 * Ex(LSDA) + 0.5 * Ex(HF) + 0.5 * Delta-Ex(B88) + Ec(LYP), which is actually somewhat different from the formulation proposed by Becke in his paper: J. Chem. Phys. 1993, 98, 1373.
    • (1993) J. Chem. Phys. , vol.98 , pp. 1373
  • 36
    • 0001869946 scopus 로고
    • Schaefer, H. F., Ed.; Plenum Press: New York
    • Dunning, T. H.; Hay, P. J. In Modern Theoretical Chemistry; Schaefer, H. F., Ed.; Plenum Press: New York. 1977, Vol. 3, pp 1-27.
    • (1977) Modern Theoretical Chemistry , vol.3 , pp. 1-27
    • Dunning, T.H.1    Hay, P.J.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.