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Volumn 60, Issue 7, 1996, Pages 1429-1441

Electronic structure and properties of MCO and M5CO carbonyls (M = Fe,Ni,Cu) by density functional methods

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EID: 0348091749     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1097-461X(1996)60:7<1429::AID-QUA25>3.0.CO;2-Y     Document Type: Article
Times cited : (5)

References (25)
  • 4
    • 0038023343 scopus 로고    scopus 로고
    • ADF 2.0.1, SCM, (Wrije Universiteit, Amsterdam)
    • ADF 2.0.1, SCM, Theorethical Chemistry (Wrije Universiteit, Amsterdam) E. J. Baerends, D. E. Ellis, and P. Ross, Chem. Phys. 2, 41 (1973); G. te Velde and E. J. Baerends, J. Comp. Phys. 99, 84 (1992).
    • Theorethical Chemistry
  • 5
    • 0038023343 scopus 로고    scopus 로고
    • ADF 2.0.1, SCM, Theorethical Chemistry (Wrije Universiteit, Amsterdam) E. J. Baerends, D. E. Ellis, and P. Ross, Chem. Phys. 2, 41 (1973); G. te Velde and E. J. Baerends, J. Comp. Phys. 99, 84 (1992).
    • (1973) Chem. Phys. , vol.2 , pp. 41
    • Baerends, E.J.1    Ellis, D.E.2    Ross, P.3
  • 6
    • 28144440701 scopus 로고
    • ADF 2.0.1, SCM, Theorethical Chemistry (Wrije Universiteit, Amsterdam) E. J. Baerends, D. E. Ellis, and P. Ross, Chem. Phys. 2, 41 (1973); G. te Velde and E. J. Baerends, J. Comp. Phys. 99, 84 (1992).
    • (1992) J. Comp. Phys. , vol.99 , pp. 84
    • Te Velde, G.1    Baerends, E.J.2
  • 11
    • 5944261746 scopus 로고
    • errata: B 34, 7406 (1986)
    • J. P. Perdew, Phys. Rev. B 33, 8822 (1986); errata: B 34, 7406 (1986).
    • (1986) Phys. Rev. B , vol.33 , pp. 8822
    • Perdew, J.P.1
  • 25
    • 0003231406 scopus 로고
    • Cluster Models for Surface Phenomena, G. Pacchioni, P. S. Bagus, F. Parmigianni, Eds. Plenum, New York
    • N. Rosch, in Cluster Models for Surface Phenomena, G. Pacchioni, P. S. Bagus, F. Parmigianni, Eds. (NATO ASI Series, Series B, Phys. Vol. 283, Plenum, New York, 1992) p. 251.
    • (1992) NATO ASI Series, Series B, Phys. , vol.283 , pp. 251
    • Rosch, N.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.