1. Institute of Chemical Research of Catalonia

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Showing results 16314 to 16333 of 62999 < previous   next >
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/pt/111 pt-4804-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--349.39992848; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/pt/111 pt-4811-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--355.76236649; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/pt/111 pt-4811-bMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--356.00017855; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/pt/111 pt-4a01-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--356.91647955; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/pt/111 pt-4a02-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--356.92565796; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/pt/111 pt-4a11-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--363.43958042; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/pt/111 pt-4a12-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--363.76809275; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/pt/111 pt-4a13-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--363.75662527; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/pt/111 pt-4a14-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--363.82339831; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/rh/111 rh-1211-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--356.75321281; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/rh/111 rh-2201-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--359.41344598; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/rh/111 rh-2401-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--366.94977467; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/rh/111 rh-2411-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--373.74737514; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/rh/111 rh-2601-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--374.48811914; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/rh/111 rh-2611-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--380.44596887; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/rh/111 rh-2612-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--381.28724353; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/rh/111 rh-3401-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--376.27316044; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/rh/111 rh-3601-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--383.66084277; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/rh/111 rh-3611-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--390.01969961; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/rh/111 rh-3611-bMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--390.41305863; eV
Showing results 16314 to 16333 of 62999 < previous   next >