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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg6-Aug-2020/opt/intermediates/Ru/CH3Cl fccPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--339.70407171; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Ru/CH3I hcpPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--339.25121464; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Rh/CH3F fccPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--274.37903174; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Ru/CH3I briPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--339.60030332; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Rh/CH3Cl briPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--273.02298710; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Rh/CH3Cl hcpPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--272.91141521; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Rh/CH3F briPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--274.45804329; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Rh/CH3F hcpPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--274.38088475; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Ru/CHCl fccPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--332.27866271; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Rh/CH3F topPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--274.47522058; eV
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