1. Institute of Chemical Research of Catalonia

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Showing results 11031 to 11050 of 62999 < previous   next >
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg21-Jun-2017Cu-1122García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---197.77328473; eV
thumbnail.jpeg20-Apr-2020cu-11eDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--27.20202715; eV
thumbnail.jpeg8-May-2017Cu-1201García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---143.89083966; eV
thumbnail.jpeg21-Jun-2017Cu-1201García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexGeometry optimization---186.84297223; eV
thumbnail.jpeg8-May-2017Cu-1211García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---150.97478952; eV
thumbnail.jpeg21-Jun-2017Cu-1211García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexGeometry optimization---193.92201844; eV
thumbnail.jpeg8-May-2017Cu-1212García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---150.45527072; eV
thumbnail.jpeg21-Jun-2017Cu-1212García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexGeometry optimization---193.48482048; eV
thumbnail.jpeg21-Jun-2017Cu-1221García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---201.43831344; eV
thumbnail.jpeg8-May-2017Cu-1301García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---148.31309895; eV
thumbnail.jpeg21-Jun-2017Cu-1301García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexGeometry optimization---191.27652988; eV
thumbnail.jpeg8-May-2017Cu-1311García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---155.53319512; eV
thumbnail.jpeg21-Jun-2017Cu-1311García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexGeometry optimization---198.49153158; eV
thumbnail.jpeg8-May-2017Cu-1312García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---154.62122465; eV
thumbnail.jpeg21-Jun-2017Cu-1312García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---197.55793641; eV
thumbnail.jpeg8-May-2017Cu-1401García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---152.61975392; eV
thumbnail.jpeg21-Jun-2017Cu-1401García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexGeometry optimization---195.53250817; eV
thumbnail.jpeg8-May-2017Cu-1411García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimization---159.09005690; eV
thumbnail.jpeg21-Jun-2017Cu-1411García Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 30 2013 18:03:31) complexGeometry optimization---202.03893312; 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
Showing results 11031 to 11050 of 62999 < previous   next >