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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg5-Jul-202407_ts_2_bis_aq_2_opt_freq_speArtigas, AlbertGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYP; RM06LCC-PVDZ CC-PVTZ GEN-3595.3656499; Eh
thumbnail.jpeg5-Jul-202410_ts_5_aq_2_opt_freq_speArtigas, AlbertGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYP; RM06LCC-PVDZ CC-PVTZ GEN-3442.4841561; Eh
thumbnail.jpeg5-Jul-202409_ts_4_aq_2_opt_freq_speArtigas, AlbertGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYP; RM06LCC-PVDZ CC-PVTZ GEN-3595.3945084; Eh
thumbnail.jpeg5-Jul-202408_ts_3_aq_2_opt_freq_speArtigas, AlbertGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYP; RM06LCC-PVDZ CC-PVTZ GEN-3595.4109596; Eh
thumbnail.jpeg5-Jul-202405_XIV_opt_freq_speArtigas, AlbertGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYP; RM06LCC-PVDZ CC-PVTZ GEN-3442.5007099; Eh
thumbnail.jpeg5-Jul-202403_XIII_aq_2_opt_freq_speArtigas, AlbertGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYP; RM06LCC-PVDZ CC-PVTZ GEN-3595.417924; Eh
thumbnail.jpeg5-Jul-202404_XIV_aq_2_opt_freq_speArtigas, AlbertGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYP; RM06LCC-PVDZ CC-PVTZ GEN-3595.4321543; Eh
thumbnail.jpeg30-Jul-202405_XV_opt_freq_speArtigas, AlbertGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYP; RM06LCC-PVDZ CC-PVTZ GEN-3442.5007099; Eh
Results 1-8 of 8 (Search time: 0.0 seconds).