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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg12-Feb-2019ss-AuIr-2322García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--247.05240304; eV
thumbnail.jpeg12-Feb-2019ss-AuCo-2501García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--225.67143794; eV
thumbnail.jpeg12-Feb-2019ss-AgIr-2011García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--210.42302614; eV
thumbnail.jpeg1-Dec-2017/Racemization/TS_H/Scan/DZP DZPGonzález Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD--2026.47243730; Eh
thumbnail.jpeg12-Feb-2019sa-ZnCd-2325García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--94.75189910; eV
thumbnail.jpeg12-Feb-2019sa-RuZn-2323García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--457.88829260; eV
thumbnail.jpeg12-Feb-2019sa-ZnCo-0211García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--73.64990258; eV
thumbnail.jpeg12-Feb-2019sa-ZnAu-0101García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--59.41455911; eV
thumbnail.jpeg12-Feb-2019sa-RuRe-2421García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--473.50015476; eV
thumbnail.jpeg12-Feb-2019sa-RuZn-2301García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--445.16068649; eV
Results 61-70 of 1824 (Search time: 0.002 seconds).