1. Institute of Chemical Research of Catalonia

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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg8-May-2017Cu-3-25García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 31 2013 08:47:18) complexImproved Dimer Method---166.36324523; eV
thumbnail.jpeg8-May-2017Ru-8-01García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexImproved Dimer Method---339.17374231; eV
thumbnail.jpeg8-May-2017Pt-4-06García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---324.77684754; eV
thumbnail.jpeg8-May-2017Ru-35309García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---383.41946041; eV
thumbnail.jpeg8-May-2017Cu-9-13García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complexFrequencies---142.95857832; eV
thumbnail.jpeg8-May-2017Ru-2315García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---353.86828840; eV
thumbnail.jpeg8-May-2017Pd-8-07García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexImproved Dimer Method---278.12787859; eV
thumbnail.jpeg8-May-2017Ru-5-35García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complexImproved Dimer Method---355.76753968; eV
thumbnail.jpeg8-May-2017Cu-6-04García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complexImproved Dimer Method---161.69456838; eV
thumbnail.jpeg8-May-2017Cu-5-21García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complexImproved Dimer Method---158.36584813; eV
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