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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg22-Jul-2017/L-N2Me2/STEP_5 Freq_step5i_M04_S12gAngelone, DavideADF; 2013; 01Single point TSDFTTZ2P-
thumbnail.jpeg22-Jul-2017/L-N2Me2/STEP_0 Freq_step0_M02_S12gAngelone, DavideADF; 2013; 01Single point MinimumDFTTZ2P-
thumbnail.jpeg22-Jul-2017/L-N2Me2/STEP_2 SP_step2_M02_S12gAngelone, DavideADF; 2016Single pointDFTTZ2P-
thumbnail.jpeg22-Jul-2017/L-N2Me2/STEP_4 Freq_step4_M06_S12gAngelone, Davide-Single point TSDFTTZ2P-
thumbnail.jpeg22-Jul-2017/L-N2Me2/STEP_2_TS23 Freq_TS23_M06_S12gAngelone, DavideADF; 2013; 01Single point TSDFTTZ2P-
thumbnail.jpeg31-Jan-2019/OPBE tz2p_Fe_IInc2co_1Swart, MarcelADF; 2009; 01Single pointDFTTZ2P-53.47644936; eV
thumbnail.jpeg22-Jul-2017/L-N2Me2/STEP_1 Freq_step1_M04_S12gAngelone, DavideADF; 2013; 01Single point TSDFTTZ2P-
thumbnail.jpeg22-Jul-2017/L-N2Me2/STEP_5 SP_step5e_M02_S12gAngelone, DavideADF; 2016Single pointDFTTZ2P-
thumbnail.jpeg31-Jan-2019/OPBE tz2p_Fe_IInc2co_3Swart, MarcelADF; 2009; 01Single pointDFTTZ2P-54.97480634; eV
Login required31-Jan-2019Water01Swart, MarcelADF; 2018Geometry optimizationDFTDZ-
Results 21-30 of 320 (Search time: 0.0 seconds).