Browsing by Author Geiger, Julian

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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-29_33Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.37651661; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-29_34Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.65186687; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-29_35Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.39573788; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-29_36Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.41717425; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-30_31Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.08739714; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-30_32Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.27767369; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-30_33Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.61925120; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-30_34Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.39636443; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-30_35Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.41969136; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-30_36Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.60944282; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-31_32Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--858.97087545; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-31_33Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.09268267; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-31_34Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.02933509; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-31_35Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.51796007; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-31_36Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.13516269; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-32_33Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.24786210; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-32_34Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.52024928; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-32_35Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.05392674; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-32_36Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.27942876; eV
thumbnail.jpeg1-Mar-2022Ru-2O-2Ce3-33_34Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--859.41467257; eV