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Volumn 105, Issue 19-22, 2007, Pages 2849-2855

Correlation energies for small magnesium clusters in comparison with bulk magnesium

Author keywords

Ab initio calculations; Electron correlations; Metals; Method of increments

Indexed keywords

CLUSTER ANALYSIS; ELECTRON CORRELATIONS; ENERGY GAP; GROUND STATE; TIME VARYING SYSTEMS;

EID: 38849090798     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/00268970701704794     Document Type: Article
Times cited : (14)

References (25)
  • 12
    • 38849107000 scopus 로고    scopus 로고
    • D. E. Woon and T. H. Dunning, Jr., to be published. Unofficial set from D. Feller [Basis sets were obtained from the Extensible Computational Chemistry Environment Basis Set Database, Version 02/02/06, as developed and distributed by the Molecular Science Computing Facility, Environmental and Molecular Sciences Laboratory, which is part of the Pacific Northwest Laboratory, P.O. Box 999, Richland, WA 99352, USA, and funded by the U.S. Department of Energy (http://www.cse.cl.rc.ac.uk/qcg/basis/)].
    • D. E. Woon and T. H. Dunning, Jr., to be published. Unofficial set from D. Feller [Basis sets were obtained from the Extensible Computational Chemistry Environment Basis Set Database, Version 02/02/06, as developed and distributed by the Molecular Science Computing Facility, Environmental and Molecular Sciences Laboratory, which is part of the Pacific Northwest Laboratory, P.O. Box 999, Richland, WA 99352, USA, and funded by the U.S. Department of Energy (http://www.cse.cl.rc.ac.uk/qcg/basis/)].
  • 15
    • 38849125023 scopus 로고    scopus 로고
    • All calculations were performed using the MOLPRO suite of ab initio programs [MOLPRO, version 2006.1, a package of ab initio programs, H.-J. Werner, P. J. Knowles, R. Lindh, F. R. Manby, M. SchûYtz, P. Celani, T. Korona, G. Rauhut, R. D. Amos, A. Bernhardsson, A, Berning, D. L. Cooper, M. J. O. Deegan, A. J. Dobbyn, F. Eckert, C. Hampel, G. Hetzer, A. W. Lloyd, S. J. McNicholas, W. Meyer, M. E. Mura, A. Nicklass, P. Palmieri, R. Pitzer, U. Schumann, H. Stoll, A. J. Stone, R. Tarroni, and T. Thorsteinsson, see
    • All calculations were performed using the MOLPRO suite of ab initio programs [MOLPRO, version 2006.1, a package of ab initio programs, H.-J. Werner, P. J. Knowles, R. Lindh, F. R. Manby, M. SchûYtz, P. Celani, T. Korona, G. Rauhut, R. D. Amos, A. Bernhardsson, A, Berning, D. L. Cooper, M. J. O. Deegan, A. J. Dobbyn, F. Eckert, C. Hampel, G. Hetzer, A. W. Lloyd, S. J. McNicholas, W. Meyer, M. E. Mura, A. Nicklass, P. Palmieri, R. Pitzer, U. Schumann, H. Stoll, A. J. Stone, R. Tarroni, and T. Thorsteinsson, see http://www.molpro.net].


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.