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Performance of diffusion Monte Carlo for the first dissociation energies of transition metal carbonyls.
Diedrich, Christian; Lüchow, Arne; Grimme, Stefan.
Affiliation
  • Diedrich C; Theoretische Organische Chemie, Organisch-Chemisches-Institut der Universität Münster, D-48149 Münster, Germany.
J Chem Phys ; 122(2): 021101, 2005 Jan 08.
Article in En | MEDLINE | ID: mdl-15638563
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Collection: 01-internacional Database: MEDLINE Language: En Journal: J Chem Phys Year: 2005 Document type: Article Affiliation country: Germany Country of publication: United States
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PubMed Links

Collection: 01-internacional Database: MEDLINE Language: En Journal: J Chem Phys Year: 2005 Document type: Article Affiliation country: Germany Country of publication: United States