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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg8-May-2019/MnN4-H2O MnN4-H2O-cleanPrslja, Paulinavasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--666.99595252; eV
thumbnail.jpeg8-May-2019/MnN4 MnN4-CO2Prslja, Paulinavasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--674.94090083; eV
thumbnail.jpeg8-May-2019/MnN4 MnN4-COPrslja, Paulinavasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--668.43409568; eV
thumbnail.jpeg8-May-2019/MnN4 MnN4-CO2HPrslja, Paulinavasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--678.81222256; eV
thumbnail.jpeg8-May-2019/MnN4 MnN4-HPrslja, Paulinavasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--655.62527831; eV
thumbnail.jpeg8-May-2019/MnN4 MnN4-cleanPrslja, Paulinavasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--652.42379573; eV
thumbnail.jpeg8-May-2019/Ni(I)N4 Ni(I)N4-CO2HPrslja, Paulinavasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--674.54842817; eV
thumbnail.jpeg8-May-2019/Ni(I)N4 Ni(I)N4-COPrslja, Paulinavasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--663.75405828; eV
thumbnail.jpeg8-May-2019/Ni(I)N4 Ni(I)N4-CO2Prslja, Paulinavasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--671.88701095; eV
thumbnail.jpeg8-May-2019/Ni(I)N4 Ni(I)N4-HPrslja, Paulinavasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--651.19519926; eV
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