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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg29-Mar-2017NR-fragsNb_Region1Serapian, StefanoADF; 2016Single pointDFTTZP-
thumbnail.jpeg29-Mar-2017Frags_Nb_region1Serapian, StefanoADF; 2016Single pointDFTTZP-
thumbnail.jpeg29-Mar-2017Frags_Nb_region2Serapian, StefanoADF; 2016Single pointDFTTZP-
thumbnail.jpeg29-Mar-2017fragsTaSerapian, StefanoADF; 2016Single pointDFT--
thumbnail.jpeg29-Mar-2017Cs-Nb6_Serapian, StefanoADF; 2016Geometry optimizationDFTTZP-
thumbnail.jpeg29-Mar-2017Cs-Ta6_Serapian, StefanoADF; 2016Geometry optimizationDFTTZP-
thumbnail.jpeg29-Mar-2017NR-fragsTaSerapian, StefanoADF; 2016Single pointDFT--
thumbnail.jpeg29-Mar-2017fragsNbSerapian, StefanoADF; 2016Single pointDFT--
thumbnail.jpeg29-Mar-2017NR-fragsNbSerapian, StefanoADF; 2016Single pointDFT--
thumbnail.jpeg29-Mar-2017NR-fragsNb_Region2Serapian, StefanoADF; 2016Single pointDFTTZP-
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