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Volumn 103, Issue 28, 1999, Pages 5590-5601

Structure and Energetics of Group 14 (IV-A) Halides: A Comparative Density Functional-Pseudopotential Study

Author keywords

[No Author keywords available]

Indexed keywords


EID: 0000684291     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp991172p     Document Type: Article
Times cited : (24)

References (67)
  • 10
    • 19944422170 scopus 로고    scopus 로고
    • Relativistic Effects in Chemistry
    • Lipkowitz, K. B., Boyd, D. B., Eds.; VCH Publishers: New York
    • Almlöf, J.; Gropen, O. Relativistic Effects in Chemistry. In Reviews in Computational Chemistry; Lipkowitz, K. B., Boyd, D. B., Eds.; VCH Publishers: New York, 1996; Vol. 8, pp 203-244.
    • (1996) Reviews in Computational Chemistry , vol.8 , pp. 203-244
    • Almlöf, J.1    Gropen, O.2
  • 16
    • 19944380529 scopus 로고    scopus 로고
    • Effective core potential approaches to the chemistry of the heavier elements
    • Lipkowitz, K. B., Boyd, D. B., Eds.; VCH Publishers: New York
    • Cundari, T. R.; Benson, M. T.; Leigh Lutz, M.; Sommerer, S. O. Effective core potential approaches to the chemistry of the heavier elements. In Reviews in Computational Chemistry; Lipkowitz, K. B., Boyd, D. B., Eds.; VCH Publishers: New York, 1996; Vol. 8, pp 145-202.
    • (1996) Reviews in Computational Chemistry , vol.8 , pp. 145-202
    • Cundari, T.R.1    Benson, M.T.2    Leigh Lutz, M.3    Sommerer, S.O.4
  • 22
    • 85034146036 scopus 로고    scopus 로고
    • note
    • The polarization functions were obtained from the Extensible Computational Chemistry Environment Basis Set Database, version 1.0, as developed and distributed by the Molecular Science Facility, Environmental and Molecular Sciences Laboratory, which is part of the Pacific Northwest Laboratory, P.O. Box 999, Richland, WA 99352, and funded by the U.S. Department of Energy. The Pacific Northwest Laboratory is a multiprogram laboratory operated by Battelle Memorial Institue for the U.S. Department of Energy under Contract DE-AC06-76RLO 1830. Contact David Feller, Karen Schuchardt, or Don Jones for further information. This information can be reached at http://www.emsl.pnl.gov:2080/docs/homepage.html.
  • 29


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.