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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg22-Jul-2017/L-N2Me2/STEP_6 SP_step6_M06_S12gAngelone, DavideADF; 2016Single pointDFTTZ2P-
thumbnail.jpeg22-Jul-2017SP_extradiol-product_S12gAngelone, DavideADF; 2016Single pointDFTTZ2P-
thumbnail.jpeg22-Jul-2017/L-N2Me2/STEP_4_TS45 Freq_TS45e_M02_S12gAngelone, DavideADF; 2013; 01Single point TSDFTTZ2P-
thumbnail.jpeg22-Jul-2017/L-N2Me2/STEP_0 Freq_step0_M06_S12gAngelone, DavideADF; 2013; 01Single point MinimumDFTTZ2P-
thumbnail.jpeg22-Jul-2017/L-N2Me2/STEP_5 Freq_step5e_M04_S12gAngelone, DavideADF; 2014Single point TS QuildDFTTZ2P-
thumbnail.jpeg22-Jul-2017/L-N2Me2/STEP_6 Freq_step6_M04_S12gAngelone, DavideADF; 2014Single point Minimum QuildDFTTZ2P-
thumbnail.jpeg22-Jul-2017/L-N2Me2/STEP_5_TS56 SP_TS56i_M02_S12gAngelone, DavideADF; 2016Single pointDFTTZ2P-
thumbnail.jpeg22-Jul-2017/L-N2Me2/STEP_1 SP_step1_M02a_S12gAngelone, DavideADF; 2016Single pointDFTTZ2P-
thumbnail.jpeg22-Jul-2017/L-N2Me2/STEP_5 SP_step5i_M06_S12gAngelone, DavideADF; 2016Single pointDFTTZ2P-
thumbnail.jpeg22-Jul-2017/L-N2Me2/STEP_5 SP_step5i_M04_S12gAngelone, DavideADF; 2016Single pointDFTTZ2P-
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