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Volumn 367, Issue 5-6, 2003, Pages 730-736

Singularity-free analytical energy gradients for the SAC/SAC-CI method: Coupled perturbed minimum orbital-deformation (CPMOD) approach

Author keywords

[No Author keywords available]

Indexed keywords


EID: 0037427727     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(02)01629-9     Document Type: Article
Times cited : (32)

References (32)
  • 22
    • 0003418034 scopus 로고
    • A New Dimension to Quantum Chemistry: Analytic Derivative Methods in Ab Initio Molecular Electronic Structure Theory
    • Oxford University Press, New Fork, Oxford
    • Y. Yamaguchi, Y. Osamura, J.D. Goddard, H.F. Schaefer III, A New Dimension to Quantum Chemistry: Analytic Derivative Methods in Ab Initio Molecular Electronic Structure Theory, Oxford University Press, New Fork, Oxford, 1994.
    • (1994)
    • Yamaguchi, Y.1    Osamura, Y.2    Goddard, J.D.3    Schaefer H.F. III4
  • 28
    • 0004170699 scopus 로고    scopus 로고
    • Development Version (Revision B.02), Gaussian, Inc., Pittsburgh, PA
    • M.J. Frisch et al., GAUSSIAN 01, Development Version (Revision B.02), Gaussian, Inc., Pittsburgh, PA, 2002.
    • (2002) GAUSSIAN 01
    • Frisch, M.J.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.