1. Institute of Chemical Research of Catalonia

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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg8-May-2017Ru-2621García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---357.86560877; eV
thumbnail.jpeg8-May-2017Ru-2223García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexGeometry optimization---357.26698811; eV
thumbnail.jpeg8-May-2017Ru-2323García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexGeometry optimization---363.91787160; eV
thumbnail.jpeg8-May-2017Ru-2225García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexGeometry optimization---364.19687021; eV
thumbnail.jpeg8-May-2017Ru-2202García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---339.27710814; eV
thumbnail.jpeg8-May-2017Ru-2401García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---345.90187622; eV
thumbnail.jpeg8-May-2017Ru-2313García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---347.14953838; eV
thumbnail.jpeg8-May-2017Ru-2513García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexGeometry optimization---360.55083117; eV
thumbnail.jpeg8-May-2017Ru-2425García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---367.48157158; eV
thumbnail.jpeg8-May-2017Ru-1011García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexFrequencies---333.99914515; eV
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