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Volumn 8, Issue 8, 2012, Pages 2653-2660

Benchmark quasi-variational coupled cluster calculations of multiple bond breaking

Author keywords

[No Author keywords available]

Indexed keywords


EID: 84864850625     PISSN: 15499618     EISSN: 15499626     Source Type: Journal    
DOI: 10.1021/ct300416b     Document Type: Article
Times cited : (31)

References (73)
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    • 0004245506 scopus 로고    scopus 로고
    • version 2010.2, a package of ab initio programs; University College Cardiff Consultants Limited: Cardiff, U.K. 2011. See (accessed July 2012)
    • Werner, H.-J.; Knowles, P. J.; Knizia, G.; Manby, F. R.; Schütz, M.; MOLPRO, version 2010.2, a package of ab initio programs; University College Cardiff Consultants Limited: Cardiff, U.K., 2011. See http://www.molpro.net (accessed July 2012).
    • MOLPRO
    • Werner, H.-J.1    Knowles, P.J.2    Knizia, G.3    Manby, F.R.4    Schütz, M.5
  • 65
    • 70549104970 scopus 로고    scopus 로고
    • an ab initio, Density Functional and Semiempirical program package, version 2.6; Universität Bonn: Bonn, Germany
    • Neese, F. ORCA, an ab initio, Density Functional and Semiempirical program package, version 2.6; Universität Bonn: Bonn, Germany, 2008.
    • (2008) ORCA
    • Neese, F.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.