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-2314García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexGeometry optimization---346.78989626; eV
thumbnail.jpeg8-May-2017Ru-0021García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexGeometry optimization---329.14473873; eV
thumbnail.jpeg8-May-2017Ru-1021García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexGeometry optimization---340.55675829; eV
thumbnail.jpeg8-May-2017Ru-2422García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---360.83447046; eV
thumbnail.jpeg8-May-2017Ru-1311García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexFrequencies---344.51643426; eV
thumbnail.jpeg8-May-2017Ru-1111García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexFrequencies---336.92232727; eV
thumbnail.jpeg8-May-2017Ru-1301García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexFrequencies---337.38625391; eV
thumbnail.jpeg8-May-2017Ru-1101García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexFrequencies---330.36244807; eV
thumbnail.jpeg8-May-2017Ru-2611García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexGeometry optimization---360.23949136; eV
thumbnail.jpeg8-May-2017Ru-2511García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---360.35669662; eV
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