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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required10-Sep-20193_ads-m_b_t-2Mates Torres, Ericvasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complexGeometry optimizationDFT--438.57857353; eV
Login required10-Sep-20193_ads-m_m_b-1Mates Torres, Ericvasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complexGeometry optimizationDFT--438.38717586; eV
Login required10-Sep-20193_ads-m_t_t-1Mates Torres, Ericvasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complexGeometry optimizationDFT--438.94363760; eV
Login required10-Sep-20193_ads-m_m_m-1Mates Torres, Ericvasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complexGeometry optimizationDFT--437.21323520; eV
Login required10-Sep-20193_ads-m_m_m-2Mates Torres, Ericvasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complexGeometry optimizationDFT--437.33279111; eV
Login required10-Sep-20193_ads-t_t_t-1Mates Torres, Ericvasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complexGeometry optimizationDFT--439.16261082; eV
Login required10-Sep-20193_ads-m_m_t-1Mates Torres, Ericvasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complexGeometry optimizationDFT--438.48567961; eV
Login required10-Sep-20193_ads-m_t_t-2Mates Torres, Ericvasp; 5.4.1; 24Jun15 (build Jun 13 2018 12:02:29) complexGeometry optimizationDFT--439.01040177; eV
thumbnail.jpeg5-Feb-2019MoS2_3x3_double_S_vacanciesBen-Melech Stan, Gabrielavasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jul 30 2017 11:30:11) complexSingle pointDFT--188.55283663; eV
thumbnail.jpeg5-Feb-2019MoS2_5x5_S_vacancyBen-Melech Stan, Gabrielavasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jul 30 2017 11:30:11) complexSingle pointDFT--535.86388827; eV
Results 101-110 of 175 (Search time: 0.002 seconds).