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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg3-Aug-2018Cu(100)-Se-H₂OGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--340.78554950; eV
thumbnail.jpeg3-Aug-2018Cu(111)-Se-XCOOHGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--159.36083554; 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-COGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--341.29551111; eV
thumbnail.jpeg3-Aug-2018Cu(211)-Te-CleanGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--144.48745994; eV
thumbnail.jpeg3-Aug-2018Cu(100)-S-COGarcía Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimizationDFT--342.40789860; eV
thumbnail.jpeg3-Aug-2018Cu(110)-HGarcía Muelas, Rodrigovasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexGeometry optimizationDFT--106.58170163; eV
thumbnail.jpeg12-Dec-2018ts-H-CO2TeKGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--160.20876192; eV
thumbnail.jpeg3-Aug-2018Cu(100)-Te-CO₂-η¹(C)García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Mar 19 2018 16:46:10) complexGeometry optimizationDFT--347.78792796; eV
thumbnail.jpeg3-Aug-2018Cu(111)-Te-HCOO-monoGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--159.96120506; eV
Results 21-30 of 274 (Search time: 0.0 seconds).