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Showing results 4411 to 4430 of 4713 < previous   next >
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required21-May-2019TS_A4PA5P_EXO_AArtigas, AlbertGaussian; 09; ES64L-G09RevE.01Single point StructureRM06Lcc-pVTZ-4020.5206297; Eh
Login required21-May-2019TS_A4PA5P_EXO_BArtigas, AlbertGaussian; 09; ES64L-G09RevE.01Single point StructureRM06Lcc-pVTZ-4020.5084893; Eh
Login required21-May-2019TS_A53AA_ENDO_AArtigas, AlbertGaussian; 09; ES64L-G09RevE.01Single point StructureRM06L--1531.1615251; Eh
Login required21-May-2019TS_A53AA_ENDO_BArtigas, AlbertGaussian; 09; ES64L-G09RevE.01Single point StructureRM06L--1531.1635467; Eh
Login required21-May-2019TS_C1A2Artigas, AlbertGaussian; 09; ES64L-G09RevE.01Single point StructureRM06Lcc-pVTZ-3674.5170916; Eh
thumbnail.jpeg20-Sep-2021TS_C2Borowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureUwB97XDDEF2TZVP-1087.40457411; Eh
thumbnail.jpeg20-Sep-2021TS_C2BBorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureUwB97XDDEF2TZVP-1087.40637505; Eh
thumbnail.jpeg20-Sep-2021TS_C2PBorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point TSRwB97XDDEF2TZVP-1087.38075401; Eh
thumbnail.jpeg20-Sep-2021TS_C2PWBorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDDEF2TZVP-1163.85455319; Eh
thumbnail.jpeg20-Sep-2021TS_C2PWBBorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDDEF2TZVP-1163.85383830; Eh
thumbnail.jpeg20-Sep-2021TS_C4Borowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point TSUwB97XDDEF2TZVP-1087.39754686; Eh
thumbnail.jpeg20-Sep-2021TS_C4BBorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point StructureUwB97XDDEF2TZVP-1087.39552987; Eh
thumbnail.jpeg20-Sep-2021TS_C4PBorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point TSRwB97XDDEF2TZVP-1087.37844519; Eh
thumbnail.jpeg20-Sep-2021TS_C4PWBorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point TSRwB97XDDEF2TZVP-1163.85726345; Eh
thumbnail.jpeg20-Sep-2021TS_C4PWBBorowski, TomaszGaussian; 16; ES64L-G16RevA.03Single point TSRwB97XDDEF2TZVP-1163.86601066; Eh
Login required22-Oct-2020TS_C60Artigas, AlbertGaussian; 09; ES64L-G09RevE.01Single point StructureRM062XCC-PVTZ-3471.279508; Eh
thumbnail.jpeg22-Oct-2020TS_C60Artigas, AlbertGaussian; 09; ES64L-G09RevE.01Single point StructureRM062XCC-PVTZ-3471.279508; Eh
Login required22-Oct-2020TS_C60Artigas, AlbertGaussian; 09; ES64L-G09RevE.01Single point StructureRM062XCC-PVTZ-3471.279508; Eh
Login required22-Oct-2020TS_C70_alphaArtigas, AlbertGaussian; 09; ES64L-G09RevE.01Single point StructureRM062XCC-PVTZ-3852.4065991; Eh
thumbnail.jpeg22-Oct-2020TS_C70_alphaArtigas, AlbertGaussian; 09; ES64L-G09RevE.01Single point StructureRM062XCC-PVTZ-3852.4065991; Eh
Showing results 4411 to 4430 of 4713 < previous   next >