Browsing by Author García Muelas, Rodrigo

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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg28-Nov-2017ss-NiFe-0111García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---296.81876991; eV
thumbnail.jpeg12-Feb-2019ss-NiFe-2211García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--317.88651185; eV
thumbnail.jpeg28-Nov-2017ss-NiFe-2215García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---317.77137184; eV
thumbnail.jpeg12-Feb-2019ss-NiFe-2522García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--335.84684581; eV
thumbnail.jpeg28-Nov-2017ss-NiIr-0000García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---283.67829309; eV
thumbnail.jpeg28-Nov-2017ss-NiIr-0011García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---291.71036825; eV
thumbnail.jpeg28-Nov-2017ss-NiIr-0111García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---295.66081250; eV
thumbnail.jpeg28-Nov-2017ss-NiIr-2215García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---317.78915073; eV
thumbnail.jpeg28-Nov-2017ss-NiOs-0000García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---310.57546835; eV
thumbnail.jpeg28-Nov-2017ss-NiOs-0011García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---319.34033550; eV
thumbnail.jpeg28-Nov-2017ss-NiOs-0111García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---323.20751708; eV
thumbnail.jpeg28-Nov-2017ss-NiOs-2215García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---344.65380716; eV
thumbnail.jpeg28-Nov-2017ss-NiPd-0000García Muelas, Rodrigovasp; 5.3.5; 31Mar14 (build Jun 1 2014 07:54:15) complexGeometry optimization---241.32438829; eV
thumbnail.jpeg28-Nov-2017ss-NiPd-0011García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---248.94943345; eV
thumbnail.jpeg28-Nov-2017ss-NiPd-0111García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---252.23551533; eV
thumbnail.jpeg28-Nov-2017ss-NiPd-2215García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---274.07554459; eV
thumbnail.jpeg12-Feb-2019ss-NiPd-2501García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--278.11069686; eV
thumbnail.jpeg12-Feb-2019ss-NiPd-2611García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--288.95534123; eV
thumbnail.jpeg28-Nov-2017ss-NiPt-0000García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---251.37339125; eV
thumbnail.jpeg28-Nov-2017ss-NiPt-0011García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---259.04328988; eV