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Volumn 108, Issue 21-23, 2010, Pages 3017-3025

What made possible the accurate calculations of NMR spin-spin coupling constants?

Author keywords

2 norbornyl cation; coupled cluster theory; EOM CC quadratic; NMR spin spin coupling

Indexed keywords

2-NORBORNYL CATION; COUPLED-CLUSTER THEORY; EOM-CC QUADRATIC; EQUATION OF MOTION COUPLED CLUSTERS; INDIRECT SPIN-SPIN COUPLING; MOLECULAR POLARIZABILITIES; SECOND ORDERS; SPIN-SPIN COUPLING CONSTANTS; SPIN-SPIN COUPLINGS; SUM OVER STATE; UNIVERSITY OF FLORIDA;

EID: 78649581035     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/00268976.2010.512567     Document Type: Conference Paper
Times cited : (14)

References (50)
  • 2
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    • J. Kowalewski, in Annual Reports on NMR Spectroscopy, edited by G.A. Webb (Academic Press, London, 1982), Vol. 12, pp. 81-176.
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    • Kowalewski, J.1
  • 14
    • 0001039562 scopus 로고
    • Part I edited by D. Yarknoy World Scientific Singapore
    • R.J. Bartlett, in Modern Electronic Structure Theory, Part I, edited by D. Yarknoy (World Scientific, Singapore, 1995), pp. 1047-1131.
    • (1995) Modern Electronic Structure Theory , pp. 1047-1131
    • Bartlett, R.J.1
  • 25
    • 78649585179 scopus 로고    scopus 로고
    • The ACES II program is a product of the Quantum Theory Project, University of Florida. Authors: J.F. Stanton, J. Gauss, S.A. Perera, A.D. Yau, J.D. Watts, M. Nooijen, N. Oliphant, P.G. Szalay, W.J. Lauderdale, S.R. Gwaltney, S. Beck, A. Balková , D.E. Bernholdt, K.-K. Baeck, H. Sekino, P. Rozyczko, C. Huber and R.J. Bartlett. Integral packages included are VMOL (J. Almlö f and P. Taylor), VPROPS (P.R. Taylor) and a modified version of the ABACUS integral derivative package (T.U. Helgaker, H.J.Aa. Jensen, J. Olsen, P. Jørgensen and P.R. Taylor)
    • The ACES II program is a product of the Quantum Theory Project, University of Florida. Authors: J.F. Stanton, J. Gauss, S.A. Perera, A.D. Yau, J.D. Watts, M. Nooijen, N. Oliphant, P.G. Szalay, W.J. Lauderdale, S.R. Gwaltney, S. Beck, A. Balková , D.E. Bernholdt, K.-K. Baeck, H. Sekino, P. Rozyczko, C. Huber and R.J. Bartlett. Integral packages included are VMOL (J. Almlö f and P. Taylor), VPROPS (P.R. Taylor) and a modified version of the ABACUS integral derivative package (T.U. Helgaker, H.J.Aa. Jensen, J. Olsen, P. Jørgensen and P.R. Taylor).
  • 42
    • 78649591883 scopus 로고    scopus 로고
    • American Chemical Society Washington DC
    • S. Borman, in Chemistry and Engineering News (American Chemical Society, Washington, DC, 1999), pp. 36-38.
    • (1999) Chemistry and Engineering News , pp. 36-38
    • Borman, S.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.