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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg2-Aug-2018MDsnap_mono_1260Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2216.57561041; eV
thumbnail.jpeg2-Aug-2018MDsnap_mono_1380Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2216.50478414; eV
thumbnail.jpeg2-Aug-2018MDsnap_mono_660Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2216.68976686; eV
thumbnail.jpeg2-Aug-2018MDsnap_mono_820Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2216.68986138; eV
thumbnail.jpeg2-Aug-2018MDsnap_mono_440Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2215.59495323; eV
thumbnail.jpeg2-Aug-2018MDsnap_mono_1480Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2215.38803153; eV
thumbnail.jpeg2-Aug-2018MDsnap_mono_580Fako, Edvinvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexSingle pointDFT--2216.58851673; eV
thumbnail.jpeg1-Jun-2024/Bulks/Alloys In₂PtMorales-Vidal, Jordivasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--
thumbnail.jpeg12-Feb-2019sa-PdAu-0011García Muelas, Rodrigovasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexGeometry optimizationDFT--245.75012689; eV
thumbnail.jpeg30-Aug-2018IX1Besora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRBP866-31g(d); sdd-1098.50417907; Eh
Results 13201-13210 of 104583 (Search time: 0.01 seconds).