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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg23-Jul-2019rol2_din2_PtFako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--1967.21841450; eV
thumbnail.jpeg5-Nov-2018_Pt1_bFako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--169.03068633; eV
thumbnail.jpeg2-Aug-2018MDsnap_trimer2_3380Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2220.62710790; eV
thumbnail.jpeg5-Nov-2018_OH1_t1Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--175.05433300; eV
thumbnail.jpeg2-Aug-2018MDsnap_trimer2_3360Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2221.09497865; eV
thumbnail.jpeg5-Nov-2018_OH1_h1Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--174.46683753; eV
thumbnail.jpeg2-Aug-2018MDsnap_trimer2_3340Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2221.29054013; eV
thumbnail.jpeg5-Nov-2018_OH1_bFako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--174.52757574; eV
thumbnail.jpeg2-Aug-2018MDsnap_trimer2_3320Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2221.59440868; eV
thumbnail.jpeg5-Nov-2018_OH1_hFako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexGeometry optimizationDFT--174.50092833; eV
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