1. Institute of Chemical Research of Catalonia

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Showing results 16574 to 16593 of 63063 < previous   next >
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-37N2-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--97.04014661; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-37N3-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--97.23520366; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-37N4-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--96.27557785; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-37N5-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--97.56368155; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-39N1-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--105.53414136; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-39N2-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--105.57919374; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-39N3-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--105.26762197; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-39N4-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--105.06962076; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-49N1-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--113.96883019; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-49N2-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--114.01782839; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-49N3-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--113.68447407; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-49N4-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--113.74775429; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-49N5-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--113.85803047; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-49N6-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--113.86409340; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-49N7-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--113.86685935; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-49N8-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--113.74779730; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-49N9-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--114.23006600; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-49Na-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--113.93967557; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-4bN1-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--122.17943632; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group3N/cd/0001 cd-4bN2-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--122.26459200; eV
Showing results 16574 to 16593 of 63063 < previous   next >