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Volumn 112, Issue 1, 2000, Pages 1-4

The analytic gradient for the equation-of-motion coupled-cluster energy with a reduced molecular orbital space: An application for the first excited state of formaldehyde

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Indexed keywords


EID: 0002099893     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.480555     Document Type: Article
Times cited : (22)

References (22)
  • 15
    • 85037498480 scopus 로고    scopus 로고
    • note
    • Advanced Concepts in Electronic Structure Theory (ACES-II), A product of the University of Florida, Quantum Theory Project, developed by J. F. Stanton, J. Gauss, J. D. Watts, M. Nooijen, N. Oliphant, S. A. Perera, P. G. Szalay, W. J. Lauderdale, S. R. Gwaltney, S. Beck, A. Balková, D. E. Bernholdt, K. K. Baeck, P. Rozyczko, H. Sekino, C. Hober, and R. J. Bartlett, Integral packages included are VMOL (J. Almlöf and P. R. Taylor); VPROPS (P. Taylor); ABACUS (T. Helgaker, H. J. Aa. Jensen, P. Jorgensen, J. Olsen, and P. R. Taylor).
  • 16
    • 85037493874 scopus 로고    scopus 로고
    • unpublished
    • K. K. Baeck (unpublished).
    • Baeck, K.K.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.