Search        

Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg4-Aug-2022/Sampling Pt-4O-surfvac-3ce3-pos_30_33_35-gammaGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--850.86534774; eV
thumbnail.jpeg4-Aug-2022/Sampling Pt-4O-surfvac-3ce3-pos_30_32_36-gammaGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Mar 02 2020 11:25:42) gamma-onlyGeometry optimizationDFT--850.64611474; eV
thumbnail.jpeg3-Mar-2022high_index-311b-pt_ads-1x1Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--388.62370475; eV
thumbnail.jpeg4-Aug-2022/Sampling Pt-4O-surfvac-3ce3-pos_30_31_34-gammaGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--850.54942745; eV
thumbnail.jpeg4-Aug-2022/Sampling Pt-4O-surfvac-3ce3-pos_28_32_33-gammaGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Mar 02 2020 11:25:42) gamma-onlyGeometry optimizationDFT--851.02260206; eV
thumbnail.jpeg4-Aug-2022/Sampling Pt-4O-surfvac-3ce3-pos_29_33_36-gammaGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Mar 02 2020 11:25:42) gamma-onlyGeometry optimizationDFT--850.81227216; eV
thumbnail.jpeg4-Aug-2022/Sampling pris-2O-surfvac-2ce3-pos_31_35-k3x3Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--844.74787176; eV
thumbnail.jpeg4-Aug-2022/Sampling pris-2O-surfvac-2ce3-pos_30_33-k3x3Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--843.96643309; eV
thumbnail.jpeg3-Mar-2022np_on_111-peroxo-4O_100-pt_adsGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--4291.72533722; eV
thumbnail.jpeg3-Mar-2022np_on_111-peroxo-4O_100-geo_optGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--4284.07655281; eV
Results 23201-23210 of 101944 (Search time: 0.012 seconds).