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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg1-Mar-2022Au-4O-1Ce3-31Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.57104004; eV
thumbnail.jpeg1-Mar-2022Au-4O-1Ce3-32Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.55779284; eV
thumbnail.jpeg1-Mar-2022Au-4O-1Ce3-33Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.41278449; eV
thumbnail.jpeg1-Mar-2022Au-4O-1Ce3-34Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--854.17858260; eV
thumbnail.jpeg1-Mar-2022Au-4O-1Ce3-35Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.77417979; eV
thumbnail.jpeg1-Mar-2022Au-4O-1Ce3-36Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.38127891; eV
thumbnail.jpeg1-Mar-2022Au-4O-2Ce3-28_29Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.59754059; eV
thumbnail.jpeg1-Mar-2022Au-4O-2Ce3-28_30Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.65971820; eV
thumbnail.jpeg1-Mar-2022Au-4O-2Ce3-28_31Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.63704437; eV
thumbnail.jpeg1-Mar-2022Au-4O-2Ce3-28_32Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.74555191; eV
thumbnail.jpeg1-Mar-2022Au-4O-2Ce3-28_33Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.68113129; eV
thumbnail.jpeg1-Mar-2022Au-4O-2Ce3-28_34Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.62210108; eV
thumbnail.jpeg1-Mar-2022Au-4O-2Ce3-28_35Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.65919562; eV
thumbnail.jpeg1-Mar-2022Au-4O-2Ce3-28_36Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.50876956; eV
thumbnail.jpeg1-Mar-2022Au-4O-2Ce3-29_30Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.73793421; eV
thumbnail.jpeg1-Mar-2022Au-4O-2Ce3-29_31Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.76940395; eV
thumbnail.jpeg1-Mar-2022Au-4O-2Ce3-29_32Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.16503007; eV
thumbnail.jpeg1-Mar-2022Au-4O-2Ce3-29_33Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.71766791; eV
thumbnail.jpeg1-Mar-2022Au-4O-2Ce3-29_34Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.69535180; eV
thumbnail.jpeg1-Mar-2022Au-4O-2Ce3-29_35Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.46300239; eV