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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg26-Aug-2020/Bodsep_porphyrins bodsep_ni3_inpSwart, MarcelADF; 2017Single pointS12g-x PBEcTZ2P-
thumbnail.jpeg26-Aug-2020/Bodsep_porphyrins bodsep_ru5_inpSwart, MarcelADF; 2017Single pointS12g-x PBEcTZ2P-
thumbnail.jpeg26-Aug-2020/Bodsep_benzene bodsep_d3h_benz_0_1_lt09_inpSwart, MarcelADF; 2019Single pointS12g-x PBEcTZ2P-
thumbnail.jpeg26-Aug-2020/Bodsep_porphyrins bodsep_pd3_inpSwart, MarcelADF; 2017Single pointS12g-x PBEcTZ2P-
thumbnail.jpeg16-Dec-2020frq_c1_1_3Swart, MarcelADF; 2019; 304Single pointS12g-x PBEcTZ2P-
thumbnail.jpeg16-Dec-2020moss_c1_1_1Swart, MarcelADF; 2019; 304Single pointS12g-x PBEcTZ2P-
thumbnail.jpeg16-Dec-2020frq_c1_1_1Swart, MarcelADF; 2019; 304Single pointS12g-x PBEcTZ2P-
thumbnail.jpeg16-Dec-2020frq_c2_2_3Swart, MarcelADF; 2019; 304Single pointS12g-x PBEcTZ2P-
thumbnail.jpeg16-Dec-2020frq_c2_2_1Swart, MarcelADF; 2019; 304Single pointS12g-x PBEcTZ2P-
thumbnail.jpeg16-Dec-2020frq_c1_1_5Swart, MarcelADF; 2019; 304Single pointS12g-x PBEcTZ2P-
Results 31-40 of 275 (Search time: 0.0 seconds).