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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg3-Aug-2018Cu(100)-OHGarcía Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimizationDFT--331.46286576; eV
thumbnail.jpeg3-Aug-2018Cu(100)-Se-HCOO-biGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--352.44282129; eV
thumbnail.jpeg3-Aug-2018Cu(100)-Se-XCOOHGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--351.38740595; eV
thumbnail.jpeg3-Aug-2018Cu(100)-CO₂-η¹(C)García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Mar 19 2018 16:46:10) complexGeometry optimizationDFT--342.62028539; eV
thumbnail.jpeg3-Aug-2018Cu(100)-Te-CleanGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--325.59489184; eV
thumbnail.jpeg3-Aug-2018Cu(100)-Te-HGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--329.18593170; eV
thumbnail.jpeg3-Aug-2018Cu(100)-HCOO-monoGarcía Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimizationDFT--347.66887935; eV
thumbnail.jpeg3-Aug-2018Cu(100)-COOHGarcía Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimizationDFT--346.75381336; eV
thumbnail.jpeg3-Aug-2018Cu(100)-O-H₂OGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--342.20861782; eV
thumbnail.jpeg3-Aug-2018Cu(100)-HCOO-biGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--347.06839149; eV
Results 61-70 of 268 (Search time: 0.018 seconds).