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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg4-Aug-2022/Sampling Pt-2O-surfvac-2ce3-pos_28_31-gammaGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--850.55767094; eV
thumbnail.jpeg4-Aug-2022/Sampling Pt-2O-surfvac-2ce3-pos_28_30-gammaGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--850.68262732; eV
thumbnail.jpeg4-Aug-2022/Sampling Pt-2O-surfvac-2ce3-pos_28_29-gammaGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--850.80349016; eV
thumbnail.jpeg4-Aug-2022/Sampling Pt-2O-surfvac-1ce3-pos_36-gammaGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--850.47916157; eV
thumbnail.jpeg4-Aug-2022/Sampling Pt-2O-surfvac-1ce3-pos_35-gammaGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--850.76201396; eV
thumbnail.jpeg4-Aug-2022/Sampling Pt-2O-surfvac-1ce3-pos_34-gammaGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--850.23952670; eV
thumbnail.jpeg4-Aug-2022/Sampling Pt-2O-surfvac-1ce3-pos_32-gammaGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--850.67044200; eV
thumbnail.jpeg4-Aug-2022/Sampling Pt-2O-surfvac-1ce3-pos_33-gammaGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--850.64296452; eV
thumbnail.jpeg4-Aug-2022/Sampling Pt-2O-surfvac-1ce3-pos_31-gammaGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--850.58083197; eV
thumbnail.jpeg4-Aug-2022/Sampling Pt-2O-surfvac-1ce3-pos_30-gammaGeiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--850.68262480; eV
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