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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_075-geo_opt-xps-o47Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--727.20369412; eV
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_075-geo_opt-xps-o48Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--727.24081878; eV
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_075-geo_opt-xps-o49Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--725.26307528; eV
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_075-geo_opt-xps-o50Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--725.25788732; eV
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_075-geo_opt-xps-o51Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--725.25788704; eV
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_075-pt_ads-xps-icorelvl0Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--595.06032340; eV
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_075-pt_ads-xps-o41Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--732.82529572; eV
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_075-pt_ads-xps-o42Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--730.24606305; eV
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_075-pt_ads-xps-o43Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--733.19709572; 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-o45Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--733.07298095; eV
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_075-pt_ads-xps-o46Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--731.93585611; eV
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_075-pt_ads-xps-o47Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--732.53910533; eV
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_075-pt_ads-xps-o48Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--733.23076036; 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-o50Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--733.08000524; 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
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_100-geo_opt-xps-icorelvl0Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--593.62972459; eV
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_100-geo_opt-xps-o45Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--731.62868490; eV
thumbnail.jpeg12-Mar-2022b110_surf-peroxo-cov_100-geo_opt-xps-o46Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--729.22755037; eV