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Volumn 127, Issue 44, 2005, Pages 15384-15385

Modeling side-on NO coordination to type 2 copper in nitrite reductase: Structures, energetics, and bonding

Author keywords

[No Author keywords available]

Indexed keywords

COPPER; NITRIC OXIDE; NITRITE REDUCTASE;

EID: 27644513403     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja0559909     Document Type: Article
Times cited : (24)

References (16)
  • 8
    • 27644546131 scopus 로고    scopus 로고
    • note
    • Unless otherwise mentioned, all calculations described here are spin-unrestricted. All calculations used the PW91 functional for both exchange and correlation and Slater-type triple-ζ plus polarization basis sets, as implemented in the ADF program system.
  • 9
    • 0034706052 scopus 로고    scopus 로고
    • For recent DFT calculations on transition metal nitrosyls from our laboratory, see: (a) Ghosh, A.; Wondimagegn, T. J. Am. Chem. Soc. 2000, 122, 8101-8102.
    • (2000) J. Am. Chem. Soc. , vol.122 , pp. 8101-8102
    • Ghosh, A.1    Wondimagegn, T.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.