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Volumn 253, Issue 5-6, 2009, Pages 575-593

Kohn-Sham DFT results projected on ligand-field models: Using DFT to supplement ligand-field descriptions and to supply ligand-field parameters

Author keywords

AOM; DFT; Ligand field; Nitrido; Tetrahedral; Vibronic

Indexed keywords


EID: 60649085554     PISSN: 00108545     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.ccr.2008.09.010     Document Type: Review
Times cited : (27)

References (123)
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  • 15
    • 60649116136 scopus 로고    scopus 로고
    • Boyens J.C.A., and Ogilvie J.F. (Eds), Springer
    • In: Boyens J.C.A., and Ogilvie J.F. (Eds). Models, Mysteries and Magic of Molecules (2007), Springer 411
    • (2007) Models, Mysteries and Magic of Molecules , pp. 411
  • 87
    • 26344471983 scopus 로고
    • Price W.C., Chissick S.S., and Ravensdale T. (Eds), Butterworths, London (Chap. 12)
    • Schäffer C.E. In: Price W.C., Chissick S.S., and Ravensdale T. (Eds). Wave Mechanics-The First 50 Years (1973), Butterworths, London 174 (Chap. 12)
    • (1973) Wave Mechanics-The First 50 Years , pp. 174
    • Schäffer, C.E.1
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    • (1946)
    • Ilse, F.E.1
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    • All DFT computations were performed using the ADF program package:
    • All DFT computations were performed using the ADF program package:. Velde G., and Baerends E.J. Comput. Phys. 99 (1992) 84
    • (1992) Comput. Phys. , vol.99 , pp. 84
    • Velde, G.1    Baerends, E.J.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.