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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg24-Aug-2020ceo2_111_pristineGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--289.24834594; eV
thumbnail.jpeg3-Mar-2022c100_surf-peroxo-cov_075-geo_opt-xps-o31Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--529.74782889; eV
thumbnail.jpeg3-Mar-2022c100_surf-peroxo-cov_075-geo_opt-xps-o32Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--529.70135470; eV
thumbnail.jpeg3-Mar-2022c100_surf-peroxo-cov_075-geo_opt-xps-o35Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--529.82293167; eV
thumbnail.jpeg3-Mar-2022b110_surf-pris-geo_opt-xps-o45Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--713.23437961; eV
thumbnail.jpeg3-Mar-2022b110_surf-peroxo-cov_100-pt_ads-xps-o43Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--737.70993098; eV
thumbnail.jpeg3-Mar-2022b110_surf-pris-pt_ads-xps-o45Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--718.47643019; eV
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_075-pt_ads-xps-o49Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--731.35999411; eV
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_075-pt_ads-xps-o44Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--730.72967993; eV
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_075-pt_ads-xps-o51Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--733.08000858; eV
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