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Volumn 111, Issue 9, 1999, Pages 4056-4067

Benchmark calculations of chemical reactions in density functional theory: Comparison of the accurate Kohn-Sham solution with generalized gradient approximations for the H2+H and H2+H2 reactions

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Indexed keywords


EID: 0000446286     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.479707     Document Type: Review
Times cited : (81)

References (49)
  • 1
    • 5944261746 scopus 로고
    • Erratum: Phys. Rev. B 34, 7406 (1986)
    • J. P. Perdew, Phys. Rev. B 33, 8822 (1986) [Erratum: Phys. Rev. B 34, 7406 (1986)].
    • (1986) Phys. Rev. B , vol.33 , pp. 8822
    • Perdew, J.P.1
  • 32
    • 85034501504 scopus 로고    scopus 로고
    • M. A. Buijse, Thesis, Vrije Universiteit, 1991
    • M. A. Buijse, Thesis, Vrije Universiteit, 1991.
  • 33
    • 0002851019 scopus 로고
    • edited by P. Ziesche and H. Eschrig Akademie, Berlin
    • J. P. Perdew, in Electronic Structure of Solids, edited by P. Ziesche and H. Eschrig (Akademie, Berlin, 1991), pp. 11-20.
    • (1991) Electronic Structure of Solids , pp. 11-20
    • Perdew, J.P.1
  • 38
    • 1542579201 scopus 로고    scopus 로고
    • edited by B. B. Laird, R. B. Ross, and T. Ziegler American Chemical Society, Washington, DC
    • E. K. U. Gross, M. Petersilka, and T. Grabo, in Chemical Applications of Density Functional Theory, Vol. 629, edited by B. B. Laird, R. B. Ross, and T. Ziegler (American Chemical Society, Washington, DC, 1996), pp. 42-53.
    • (1996) Chemical Applications of Density Functional Theory , vol.629 , pp. 42-53
    • Gross, E.K.U.1    Petersilka, M.2    Grabo, T.3
  • 42
    • 1542578641 scopus 로고    scopus 로고
    • edited by B. B. Laird, R. B. Ross, and T. Ziegler American Chemical Society, Washington, DC
    • J. P. Perdew, K. Burke, and M. Ernzerhof, in Chemical Applications of Density Functional Theory, Vol. 629, edited by B. B. Laird, R. B. Ross, and T. Ziegler (American Chemical Society, Washington, DC, 1996), pp. 453-462.
    • (1996) Chemical Applications of Density Functional Theory , vol.629 , pp. 453-462
    • Perdew, J.P.1    Burke, K.2    Ernzerhof, M.3


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.