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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg16-May-2018MECH_TS4Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointPBE--2075.02729776; eV
thumbnail.jpeg16-May-2018MECH_TS3Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointPBE--2073.27662433; eV
thumbnail.jpeg16-May-2018H2_a6Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationPBE--1990.71118979; eV
thumbnail.jpeg16-May-2018AuCl_mobility_b6_tsFako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationPBE--1985.92753946; eV
thumbnail.jpeg16-May-2018AuCl_mobility_b4Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationPBE--1990.50007846; eV
thumbnail.jpeg16-May-2018AuCl_mobility_b7Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationPBE--1986.13812281; eV
thumbnail.jpeg16-May-2018AuCl_mobility_b6Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationPBE--1985.92753946; eV
thumbnail.jpeg16-May-2018MECH_c5Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationPBE--2076.11709051; eV
thumbnail.jpeg16-May-2018MECH_c4Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationPBE--2073.99554935; eV
thumbnail.jpeg16-May-2018MECH_c3Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationPBE--2074.77142704; eV
Results 21-30 of 99 (Search time: 0.001 seconds).