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Volumn 105, Issue 22, 1996, Pages 9933-9947

Density functional theory study of some structural and energetic properties of small lithium clusters

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION; APPROXIMATION THEORY; ATOMS; BINDING ENERGY; CHEMICAL BONDS; CONFORMATIONS; CORRELATION METHODS; ELECTRONIC PROPERTIES; IONIZATION; MOLECULAR DYNAMICS; MOLECULAR VIBRATIONS;

EID: 0030575969     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.472826     Document Type: Article
Times cited : (102)

References (56)
  • 2
    • 85033040285 scopus 로고    scopus 로고
    • 53, 510(E) (1984)
    • 53, 510(E) (1984).
  • 21
    • 4243606192 scopus 로고
    • R. Car and M. Parrinello, Phys. Rev. Lett. 55, 2471 (1985); proceedings of the NATO ARW: Simple Molecular Systems at Very High Density, Les Houches (France), NATO ASI Series (Plenum, New York, 1988), p. 455.
    • (1988) , pp. 455
  • 22
    • 0007076481 scopus 로고
    • (a) U. Röthlisberger and W. Andreoni, J. Chem. Phys. 94, 8129 (1991); (b) U. Röthlisberger, W. Andreoni, and P. Giannozzi, ibid. 96, 1248 (1992).
    • (1991) J. Chem. Phys. , vol.94 , pp. 8129
    • Röthlisberger, U.1    Andreoni, W.2
  • 29
    • 0002851019 scopus 로고    scopus 로고
    • edited by P. Ziesche and H. Eschrig Academic Verlag, Berlin
    • J. P. Perdew, in Electronic Structure of Solids '91, edited by P. Ziesche and H. Eschrig (Academic Verlag, Berlin, 1991).
    • Electronic Structure of Solids ' , vol.91 , pp. 1991
    • Perdew, J.P.1
  • 30
    • 5944261746 scopus 로고
    • 38, 7406(E) (1986).
    • J. P. Perdew, Phys. Rev. B 33, 8822 (1986); 38, 7406(E) (1986).
    • (1986) Phys. Rev. B , vol.33 , pp. 8822
    • Perdew, J.P.1
  • 38
    • 85033064699 scopus 로고
    • Ph.D. thesis, Université de Montréal
    • A. St Amant, Ph.D. thesis, Université de Montréal (1991).
    • (1991)
    • St Amant, A.1
  • 40
    • 28144440701 scopus 로고
    • ADF release 1.02, Department of Theoretical Chemistry, Vrije Universiteit, Amsterdam.
    • (b) G. te Velde and E. J. Baerends, J. Comput. Phys. 99, 84 (1992); ADF release 1.02, Department of Theoretical Chemistry, Vrije Universiteit, Amsterdam.
    • (1992) J. Comput. Phys. , vol.99 , pp. 84
    • Te Velde, G.1    Baerends, E.J.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.