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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg2-Aug-2018MDsnap_dimer2_2760Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2219.94639293; eV
thumbnail.jpeg2-Aug-2018MDsnap_dimer1_4380Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2221.13785863; eV
thumbnail.jpeg2-Aug-2018MDsnap_dimer1_1600Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2220.48364738; eV
thumbnail.jpeg12-Feb-2019ol-PdRh-1312García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--287.05487265; eV
thumbnail.jpeg12-Feb-2019ol-OsFe-1401García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--505.90197717; eV
thumbnail.jpeg12-Feb-2019ol-NiPd-0101García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--250.80964894; eV
thumbnail.jpeg2-Aug-2018MDsnap_trimer1_1740Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2222.15806818; eV
thumbnail.jpeg2-Aug-2018MDsnap_dimer2_1800Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2219.76707485; eV
thumbnail.jpeg2-Aug-2018MDsnap_dimer1_3080Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2221.35632028; eV
thumbnail.jpeg2-Aug-2018MDsnap_dimer2_2240Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2218.22625942; eV
Results 34041-34050 of 103569 (Search time: 0.022 seconds).