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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg24-Oct-20231oxy,_dir_Ag140_GCN6_32Bruix, Albertvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--351.00262888; eV
thumbnail.jpeg24-Oct-20231oxy,_dir_Ag140_GCN5_72Bruix, Albertvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--351.29293205; eV
thumbnail.jpeg24-Oct-20231oxy,_dir_Ag140_GCN6_89Bruix, Albertvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--351.00523206; eV
thumbnail.jpeg24-Oct-20231oxy,_dir_Ag140_GCN6_95Bruix, Albertvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--350.86866340; eV
thumbnail.jpeg24-Oct-20231oxy,_dir_Ag140_GCN6_67Bruix, Albertvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--351.00462431; eV
thumbnail.jpeg24-Oct-20231oxy,_dir_Ag140_GCN5_95Bruix, Albertvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--350.98573320; eV
thumbnail.jpeg24-Oct-20231oxy,_dir_Ag140_GCN7_17Bruix, Albertvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--350.86908071; eV
thumbnail.jpeg24-Oct-2023more_than_7_edge,_not_most_stable_dir_Ag140_7oxyBruix, Albertvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:31:20) gamma-onlyGeometry optimizationDFT--385.68228784; eV
thumbnail.jpeg24-Oct-2023more_than_7_edge,__dir_Ag140_12_oxy_continuumBruix, Albertvasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-onlyGeometry optimizationDFT--414.53588935; eV
thumbnail.jpeg24-Oct-2023edge,_dir_Ag140_42oxy_12edgesBruix, Albertvasp; 5.4.1; 24Jun15 (build Nov 08 2016 15:58:32) gamma-onlyGeometry optimizationDFT--583.62211947; eV
Results 31-40 of 63 (Search time: 0.001 seconds).