1. Institute of Chemical Research of Catalonia

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Showing results 16300 to 16319 of 63196 < previous   next >
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-2601-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--448.81357418; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-2611-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--454.75023792; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-2612-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--455.64230965; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-3401-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--450.74669144; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-3601-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--457.96762524; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-3611-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--464.33857737; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-3611-bMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--464.72626389; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-3801-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--465.53262733; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-3811-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--471.78183590; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-3812-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--472.27998757; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-3813-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--472.38160609; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-4601-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--466.02373806; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-4602-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--467.29336264; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-4801-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--474.54653649; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-4802-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--474.64097250; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-4803-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--474.61409376; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-4804-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--474.63500752; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-4811-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--481.00456977; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-4811-bMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--481.38800265; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ir/111 ir-4a01-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--482.17102440; eV
Showing results 16300 to 16319 of 63196 < previous   next >