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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required27-Sep-2021SCO_B3LYPSTAR_S16_HSVidal, DanielGaussian; 16; ES64L-G16RevB.01Single point StructureUBLYPDEF2TZVP-2630.37885422; Eh
Login required27-Sep-2021SCO_B3LYPSTAR_S16_LSVidal, DanielGaussian; 16; ES64L-G16RevB.01Single point StructureUBLYPDEF2TZVP-2630.38909229; Eh
Login required27-Sep-2021SCO_B3LYPSTAR_S15_LSVidal, DanielGaussian; 16; ES64L-G16RevB.01Single point StructureUBLYPDEF2TZVP-2888.95170900; Eh
Login required27-Sep-2021SCO_B3LYPSTAR_S17_LSVidal, DanielGaussian; 16; ES64L-G16RevB.01Single point StructureUBLYPDEF2TZVP-2433.98235835; Eh
Login required27-Sep-2021SCO_B3LYPSTAR_S18_LS_OLDVidal, DanielGaussian; 16; ES64L-G16RevB.01Single point StructureUBLYPDEF2TZVP-2819.02875522; Eh
Login required27-Sep-2021SCO_B3LYPSTAR_S18_HS_OLDVidal, DanielGaussian; 16; ES64L-G16RevB.01Single point StructureUBLYPDEF2TZVP-2819.03207165; Eh
Login required27-Sep-2021SCO_B3LYPSTAR_S18_LSVidal, DanielGaussian; 16; ES64L-G16RevB.01Single point StructureUBLYPDEF2TZVP-2819.07646446; Eh
Login required27-Sep-2021SCO_B3LYPSTAR_S18_HSVidal, DanielGaussian; 16; ES64L-G16RevB.01Single point MinimumUBLYPDEF2TZVP-2819.06653376; Eh
Login required27-Sep-2021SCO_SO_HighSpin_3_HSVidal, DanielGaussian; 16; ES64L-G16RevB.01Single point StructureUBLYPDEF2TZVP-2803.72040212; Eh
Login required27-Sep-2021SCO_SO_HighSpin_2_LSVidal, DanielGaussian; 16; ES64L-G16RevB.01Single point StructureUBLYPDEF2TZVP-3237.94208514; Eh
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