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Volumn 6, Issue 12, 2010, Pages 3647-3663

Continuous localized orbital corrections to density functional theory: B3LYP-CLOC

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EID: 78651327756     PISSN: 15499618     EISSN: 15499626     Source Type: Journal    
DOI: 10.1021/ct100418n     Document Type: Article
Times cited : (9)

References (30)
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    • 35748980308 scopus 로고    scopus 로고
    • For a review of DFT, the history of functional development, and an assessment of the performances of various popular functionals, see: Sousa, S. F.; Fernandes, P. A.; Ramos, M. J. J. Phys. Chem. A. 2007, 111, 10439-10452.
    • (2007) J. Phys. Chem. A. , vol.111 , pp. 10439-10452
    • Sousa, S.F.1    Fernandes, P.A.2    Ramos, M.J.3
  • 19
    • 0035841952 scopus 로고    scopus 로고
    • (e) Cremer, D. Mol. Phys. 2001, 99, 1899-1940.
    • (2001) Mol. Phys. , vol.99 , pp. 1899-1940
    • Cremer, D.1
  • 21
    • 78651281563 scopus 로고    scopus 로고
    • version 2006.1; MOLPRO: Cardiff, U.K.
    • MOLPRO, version 2006.1; MOLPRO: Cardiff, U.K., 2006.
    • (2006) MOLPRO
  • 22
    • 78651272466 scopus 로고    scopus 로고
    • version 7.6; Schrödinger, LLC: New York
    • Jaguar, version 7.6; Schrödinger, LLC: New York, 2009.
    • (2009) Jaguar
  • 24
    • 70349971100 scopus 로고    scopus 로고
    • (a) For reviews of the application of DFT to the study of organic chemistry and biochemistry, see: Roos, G.; Geerlings, P.; Messens, J. J. Phys. Chem. B. 2009, 113, 13465-13475.
    • (2009) J. Phys. Chem. B. , vol.113 , pp. 13465-13475
    • Roos, G.1    Geerlings, P.2    Messens, J.3


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.