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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/ru/0001 ru-4a14-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--504.17616168; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-1211-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--76.14029013; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-2201-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--76.93793739; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-2401-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--86.03026434; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-2411-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--93.19531669; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-2601-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--94.55563483; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-2611-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--100.47991411; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-2612-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--101.12610527; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-3401-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--93.99840433; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-3601-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--102.84793655; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-3611-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--110.06326428; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-3611-bMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--110.16298148; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-3801-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--111.21370887; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-3811-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--117.33297666; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-3812-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--117.70502089; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-3813-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--117.89057050; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-4601-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--110.83908002; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-4602-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--110.63806790; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-4801-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--119.45025224; eV
thumbnail.jpeg28-Sep-2022/FG_dataset/group2/zn/0001 zn-4802-aMorandi, Santiagovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--119.60777402; eV