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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg10-May-2016/empty_capsules_single_point C76_SBSBSerapian, StefanoADF; 2013; 01Single pointDFTTZP-
thumbnail.jpeg10-May-2016/single_point_half_capsules C70_SASA_half2Serapian, StefanoADF; 2013; 01Single pointDFTTZP-
thumbnail.jpeg10-May-2016/full_capsule_optimisations C90_ABABSerapian, StefanoADF; 2013; 01Geometry optimizationDFTTZP-88.91908123; Eh
thumbnail.jpeg10-May-2016/full_capsule_optimisations C70_SASASerapian, StefanoADF; 2013; 01Geometry optimizationDFTTZP-82.24291938; Eh
thumbnail.jpeg10-May-2016/optimised_half_capsules SASerapian, StefanoADF; 2013; 01Geometry optimizationDFTTZP-29.62636625; Eh
thumbnail.jpeg10-May-2016/single_point_half_capsules C60_AASB_half1Serapian, StefanoADF; 2013; 01Single pointDFTTZP-
thumbnail.jpeg10-May-2016/single_point_half_capsules C84_SBSB_half1Serapian, StefanoADF; 2013; 01Single pointDFTTZP-
thumbnail.jpeg10-May-2016/single_point_half_capsules C70_SBSB_half1Serapian, StefanoADF; 2013; 01Single pointDFTTZP-
thumbnail.jpeg10-May-2016/single_point_half_capsules C84_ABSA_half1Serapian, StefanoADF; 2013; 01Single pointDFTTZP-
thumbnail.jpeg10-May-2016/single_point_half_capsules C84_ABAB_half2Serapian, StefanoADF; 2013; 01Single pointDFTTZP-
Results 21-30 of 4979 (Search time: 0.003 seconds).