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Volumn 101, Issue 35, 1997, Pages 6903-6913

Cu-dinitrosyl species in zeolites: A density functional molecular cluster study

Author keywords

[No Author keywords available]

Indexed keywords

BINDING ENERGY; CARBON MONOXIDE; CHEMICAL BONDS; DECOMPOSITION; ELECTRONIC STRUCTURE; MATHEMATICAL MODELS; MOLECULAR STRUCTURE; NITROGEN OXIDES;

EID: 0031207007     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp962706e     Document Type: Article
Times cited : (57)

References (83)
  • 50
    • 85081466619 scopus 로고    scopus 로고
    • Complete details of all structures are available directly from the authors
    • Complete details of all structures are available directly from the authors.
  • 64
    • 85081462381 scopus 로고    scopus 로고
    • note
    • 2+ in Table 3 are slightly different from the corresponding values in ref 36.
  • 80
    • 85081465774 scopus 로고    scopus 로고
    • note
    • That it is a quadruply excited state can be seen by rearranging the electrons in the left (and middle) of Figure 7 (thereby creating an excited state), so that levels of the same symmetry remain occupied on going to the right.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.