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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg3-Aug-2018Cu(110)-Se-XCOOHGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--133.73083096; eV
thumbnail.jpeg3-Aug-2018Cu(110)-Te-OHGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--119.04112723; eV
thumbnail.jpeg3-Aug-2018Cu(110)-Te-CleanGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--108.16946754; eV
thumbnail.jpeg3-Aug-2018Cu(110)-Te-HGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--111.68834692; eV
thumbnail.jpeg3-Aug-2018Cu(110)-Te-CO₂-η²(C_O)García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--129.79856435; eV
thumbnail.jpeg3-Aug-2018Cu(110)-Te-HCOO-biGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--134.61671568; eV
thumbnail.jpeg3-Aug-2018Cu(110)-Te-H₂OGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--122.95910443; eV
thumbnail.jpeg3-Aug-2018Cu(110)-Te-XCOOHGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--133.23937653; eV
thumbnail.jpeg3-Aug-2018Cu(110)-Te-COGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--123.50988074; eV
thumbnail.jpeg3-Aug-2018Cu(110)-Te-SHGarcía Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--110.36579562; eV
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