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464 related items for PubMed ID: 20050644

  • 1. Density functional investigation of structure and stability of Ge(n) and Ge(n)Ni (n = 1-20) clusters: validity of the electron counting rule.
    Bandyopadhyay D, Sen P.
    J Phys Chem A; 2010 Feb 04; 114(4):1835-42. PubMed ID: 20050644
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  • 2. A computational investigation of copper-doped germanium and germanium clusters by the density-functional theory.
    Wang J, Han JG.
    J Chem Phys; 2005 Dec 22; 123(24):244303. PubMed ID: 16396533
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  • 5. Structural and electronic properties of Al12X+ (X=C, Si, Ge, Sn, and Pb) clusters.
    Chen G, Kawazoe Y.
    J Chem Phys; 2007 Jan 07; 126(1):014703. PubMed ID: 17212507
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  • 6. Density-functional study of small neutral and cationic bismuth clusters Bi(n) and Bi(n) (+)(n=2-24).
    Yuan HK, Chen H, Kuang AL, Miao Y, Xiong ZH.
    J Chem Phys; 2008 Mar 07; 128(9):094305. PubMed ID: 18331091
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  • 9. Computational investigation of TiSin (n=2-15) clusters by the density-functional theory.
    Guo LJ, Liu X, Zhao GF, Luo YH.
    J Chem Phys; 2007 Jun 21; 126(23):234704. PubMed ID: 17600432
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  • 10. Al7Ag and Al7Au clusters with large highest occupied molecular orbital-lowest unoccupied molecular orbital gap.
    Chen MX, Yan XH, Wei SH.
    J Phys Chem A; 2007 Sep 06; 111(35):8659-62. PubMed ID: 17696321
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  • 12. Architecture, electronic structure and stability of TM@Ge(n) (TM = Ti, Zr and Hf; n = 1-20) clusters: a density functional modeling.
    Kumar M, Bhattacharyya N, Bandyopadhyay D.
    J Mol Model; 2012 Jan 06; 18(1):405-18. PubMed ID: 21625900
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  • 13. Evolution of the geometrical and electronic structures of Gan(n=2-26) clusters: a density-functional theory study.
    Song B, Cao PL.
    J Chem Phys; 2005 Oct 08; 123(14):144312. PubMed ID: 16238396
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  • 16. Structure and stability of Al-doped boron clusters by the density-functional theory.
    Feng XJ, Luo YH.
    J Phys Chem A; 2007 Mar 29; 111(12):2420-5. PubMed ID: 17388307
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  • 17. Structures and energetics of neutral and ionic silicon-germanium clusters: density functional theory and coupled cluster studies.
    Wang YS, Chao SD.
    J Phys Chem A; 2011 Mar 10; 115(9):1472-85. PubMed ID: 21322541
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  • 20. Al(n)Bi clusters: transitions between aromatic and jellium stability.
    Jones CE, Clayborne PA, Reveles JU, Melko JJ, Gupta U, Khanna SN, Castleman AW.
    J Phys Chem A; 2008 Dec 25; 112(51):13316-25. PubMed ID: 19053539
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