Journal of Atomic and Molecular Physics, Volume. 25, Issue 2, 281(2008)

A First-Principles Study on the interatomic potentials of Ⅱ-Ⅵ compounds

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    References(4)

    [3] [3] Kokn W,Sham L.Self-consistent equations including exchange and correlation effects[J].Phys.Rev.,1965,140:A1133

    [6] [6] Becke A D.Density-functional exchange-energy approximation with correct asymptotic behavior[J].Phys.Rev.A,1988,38:3098

    [8] [8] Kemner K M,Bunker B A,Luo H,et al.Extended X-ray-absorption fine-structure studies of interfaces in znTe/CdSe superlattices[J].Phys.Rev.B,1992,46:7274

    [10] [10] Xu X W A.Goddard Ⅲ.The X3LYP extended density functional for accurate descriptions of nonbond interactions,spin states,and thermochemical properties[J].Proc.Natl.Acad.Sci.USA,2004,101:2673

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    [in Chinese], [in Chinese], [in Chinese]. A First-Principles Study on the interatomic potentials of Ⅱ-Ⅵ compounds[J]. Journal of Atomic and Molecular Physics, 2008, 25(2): 281

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    Paper Information

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    Received: Mar. 12, 2007

    Accepted: --

    Published Online: Aug. 17, 2008

    The Author Email: (yyy197905@163.com)

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