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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg6-Aug-2020/opt/intermediates/Pt/CF fccPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--225.91074878; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Pt/CF hcpPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--225.80230731; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Pt/CH2F2 lesserPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--236.97405030; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Pt/CH2Cl topPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--231.48283751; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Pt/CH2F topPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--232.93981091; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Pt/CH2I2 lesserPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--232.36092392; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Pt/CH3Cl briPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--235.06214100; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Pt/CH3Cl fccPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--234.95302936; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Pt/CH2I topPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--230.97207622; eV
thumbnail.jpeg6-Aug-2020/opt/intermediates/Pt/CH3Cl topPablo-García, Sergiovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--235.15651099; eV
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