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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/pt/111 pt-4823-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--362.61594800; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/pt/111 pt-4824-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--362.72434611; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/pt/111 pt-4825-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--362.92850759; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/pt/111 pt-4826-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--362.83035299; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/pt/111 pt-4831-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--369.99116864; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/pt/111 pt-4832-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--369.94319486; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/pt/111 pt-4833-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--369.38353856; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/rh/111 rh-1221-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--363.86924892; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/rh/111 rh-1231-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--371.47367257; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/rh/111 rh-2421-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--380.72970904; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/rh/111 rh-2422-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--380.21162040; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/rh/111 rh-2431-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--387.37623503; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/rh/111 rh-3621-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--397.39807836; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/rh/111 rh-3622-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--396.98473271; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/rh/111 rh-3623-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--397.21898969; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/rh/111 rh-3631-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--404.37272548; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/rh/111 rh-3632-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--403.66645609; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/rh/111 rh-4821-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--414.12820648; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/rh/111 rh-4822-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--414.04948516; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group4/rh/111 rh-4823-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--413.65426946; eV