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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required12-Aug-2021/bulk Cu-bulkDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--3.72627540; eV
Login required12-Aug-2021/redCO2 Cu6Sn5(102)-HCOODattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--362.72361972; eV
Login required12-Aug-2021/redCO2 Cu(111)-1Sn-COOHDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--224.48616961; eV
Login required12-Aug-2021/redCO2 Cu(111)-SnO3-CleanDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--222.88666761; eV
Login required12-Aug-2021/redCO2 Cu(111)-1Sn-CleanDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--198.49756273; eV
Login required12-Aug-2021/XPS XPS-Cu6Sn5(102)-Sn-3dDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--271.31850753; eV
Login required12-Aug-2021/XPS XPS-Cu(111)-1Sn-Cu-2pDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--478.67334233; eV
Login required12-Aug-2021/redCO2 Cu(100)-COOHDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--221.31706240; eV
Login required12-Aug-2021/redCO2 Cu(111)-HDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--200.94169375; eV
Login required12-Aug-2021/bulk Cu6Sn5-bulkDattila, Federicovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--166.92882167; eV
Results 1661-1670 of 1670 (Search time: 0.002 seconds).