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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg5-Jul-2024c60_X_complex_opt_freqArtigas, AlbertGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ-3471.60693949; Eh
thumbnail.jpeg5-Jul-2024c60_X_ts_opt_freqArtigas, AlbertGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPCC-PVDZ-3471.58215441; Eh
thumbnail.jpeg5-Jul-20242a_opt_freqArtigas, AlbertGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ-3471.66402501; Eh
thumbnail.jpeg5-Jul-202412_ts_4_bis_opt_freqArtigas, AlbertGaussian; 16; ES64L-G16RevB.01Geometry optimization TSRB3LYPCC-PVDZ GEN-3442.13505051; Eh
thumbnail.jpeg5-Jul-202411_ts_4_opt_freqArtigas, AlbertGaussian; 16; ES64L-G16RevB.01Geometry optimization TSRB3LYPCC-PVDZ GEN-3442.14774262; Eh
thumbnail.jpeg5-Jul-202406_Rh_X_bis_opt_freqArtigas, AlbertGaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRB3LYPCC-PVDZ GEN-3442.18053843; Eh
thumbnail.jpeg5-Jul-202404_XIII_opt_freqArtigas, AlbertGaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRB3LYPCC-PVDZ GEN-3442.16855801; Eh
thumbnail.jpeg5-Jul-202403_XII_opt_freqArtigas, AlbertGaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRB3LYPCC-PVDZ GEN-3442.12648421; Eh
thumbnail.jpeg5-Jul-202405_Rh_X_opt_freqArtigas, AlbertGaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRB3LYPCC-PVDZ GEN-3442.16500979; Eh
thumbnail.jpeg5-Jul-202402_XI_opt_freqArtigas, AlbertGaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRB3LYPCC-PVDZ GEN-3442.18055781; Eh
Results 1-10 of 32 (Search time: 0.001 seconds).