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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg16-May-2018MECH_c1Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationPBE--1993.72755200; eV
thumbnail.jpeg16-May-2018MECH_c2Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationPBE--1994.80828523; eV
thumbnail.jpeg16-May-2018AuCl_mobility_b4_tsFako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jan 31 2018 20:07:36) complexGeometry optimizationPBE--1990.41336024; eV
thumbnail.jpeg16-May-2018AuCl_mobility_b1Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationPBE--1996.36068711; eV
thumbnail.jpeg16-May-2018AuCl_mobility_b1_tsFako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jan 31 2018 20:07:36) complexGeometry optimizationPBE--1995.52880339; eV
thumbnail.jpeg16-May-2018AuCl_mobility_b5Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationPBE--1990.16359759; eV
thumbnail.jpeg16-May-2018AuCl_mobility_b3_tsFako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jan 31 2018 20:07:36) complexGeometry optimizationPBE--2011.05988109; eV
thumbnail.jpeg16-May-2018AuCl_mobility_b2Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationPBE--1995.79714017; eV
thumbnail.jpeg16-May-2018Au_mobility_a6Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationPBE--1983.81266948; eV
thumbnail.jpeg16-May-2018Au_mobility_a6_tsFako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jan 31 2018 20:07:36) complexGeometry optimizationPBE--1980.62896380; eV
Results 31-40 of 99 (Search time: 0.001 seconds).