메뉴 건너뛰기




Volumn 253, Issue 1-2, 1996, Pages 196-200

The covalently bound N3O2 molecule: Two possible isomers

Author keywords

[No Author keywords available]

Indexed keywords


EID: 0030602521     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/0009-2614(96)00227-8     Document Type: Article
Times cited : (13)

References (19)
  • 6
    • 85136559175 scopus 로고    scopus 로고
    • note
    • 2O is estimated to be 7.7 kcal/mol (see Ref. [2]).
  • 11
    • 5944261746 scopus 로고
    • erratum in Phys. Rev. B 38 (1986) 7406
    • [11] J.P. Perdew, Phys. Rev. B 33 (1986) 8822; erratum in Phys. Rev. B 38 (1986) 7406.
    • (1986) Phys. Rev. B , vol.33 , pp. 8822
    • Perdew, J.P.1
  • 13
    • 0011521391 scopus 로고
    • Ph.D. thesis Université de Montréal
    • [13] A. St-Amant, Ph.D. thesis (Université de Montréal, 1991).
    • (1991)
    • St-Amant, A.1
  • 16
    • 85136572637 scopus 로고    scopus 로고
    • note
    • 2 calculations. In deMon the electron density and the exchange-correlation potential are fitted using auxiliary sets of Gaussian functions, while in Gaussian94/DFT no such an expansion is employed. Also, the integration grids are different in the two implementations.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.