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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg1-Mar-2022Au-3O-2Ce3-30_34Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.90888352; eV
thumbnail.jpeg1-Mar-2022Au-3O-2Ce3-29_33Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.90758941; eV
thumbnail.jpeg1-Mar-2022Au-3O-2Ce3-28_33Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.89829341; eV
thumbnail.jpeg1-Mar-2022Au-3O-2Ce3-29_36Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.88585059; eV
thumbnail.jpeg1-Mar-2022Au-3O-1Ce3-35Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.77152624; eV
thumbnail.jpeg1-Mar-2022Au-3O-0Ce3-00Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.87917637; eV
thumbnail.jpeg4-Sep-2023pbepbeSP_I1García-Padilla, EduardoGaussian; 09; EM64L-G09RevD.01Single point StructureRPBEPBE6-311+G(D,P) SDD GENECP-1060.4364006; Eh
thumbnail.jpeg1-Mar-2022Au-2O-2Ce3-34_35Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--854.63146897; eV
thumbnail.jpeg1-Mar-2022Au-3O-2Ce3-29_32Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.88959740; eV
thumbnail.jpeg1-Mar-2022Au-3O-2Ce3-28_29Geiger, Julianvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyGeometry optimizationDFT--853.87842143; eV
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