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-2-27García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 31 2013 08:47:18) complexGeometry optimization---170.16199771; eV
thumbnail.jpeg8-May-2017Cu-5-34García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 31 2013 08:47:18) complexImproved Dimer Method---165.50044734; eV
thumbnail.jpeg8-May-2017Cu-3-39García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 31 2013 08:47:18) complexImproved Dimer Method---166.91028038; eV
thumbnail.jpeg8-May-2017Cu-2-23García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 31 2013 08:47:18) complexImproved Dimer Method---171.18770882; eV
thumbnail.jpeg8-May-2017Cu-2-01García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complexImproved Dimer Method---175.90996482; eV
thumbnail.jpeg8-May-2017Cu-2-17García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complexImproved Dimer Method---170.24498885; eV
thumbnail.jpeg8-May-2017Cu-2-28García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 31 2013 08:47:18) complexImproved Dimer Method---170.58551140; eV
thumbnail.jpeg8-May-2017Cu-4-55García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 31 2013 08:47:18) complexImproved Dimer Method---162.45936855; eV
thumbnail.jpeg8-May-2017Cu-4-48García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 31 2013 08:47:18) complexImproved Dimer Method---162.40668200; eV
thumbnail.jpeg8-May-2017Cu-5-01García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complexImproved Dimer Method---164.67380072; eV
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