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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg20-Jul-2022/TA_TT_energy_study Bach_iPr_TA_TS1_MeGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPGENECP-1788.58315082; Eh
thumbnail.jpeg20-Jul-2022/fDavies_Ph fDavies_Ph_TT_TS1Guo, WentaoGaussian; 16; ES64L-G16RevA.03Single point MinimumRB3LYPGENECP-14577.8622587; Eh
thumbnail.jpeg20-Jul-2022/Bach_iPr_system Bach_iPr_TA_TS1Guo, WentaoGaussian; 16; ES64L-G16RevC.01Single point StructureRB3LYPGENECP-4320.06430740; Eh
thumbnail.jpeg20-Jul-2022/Davies_Ph Davies_Ph_CT_VTS1Guo, WentaoGaussian; 16; ES64L-G16RevA.03Single point StructureRB3LYPGENECP-4547.71118061; Eh
thumbnail.jpeg20-Jul-2022/Davies_Me Davies_Me_CT_VTS1Guo, WentaoGaussian; 16; ES64L-G16RevA.03Single point StructureRB3LYPGENECP-4355.96355296; Eh
thumbnail.jpeg20-Jul-2022/Bach_iPr_system Bach_iPr_CT_VTS1Guo, WentaoGaussian; 16; AS64L-G16RevC.01Single point StructureRB3LYP6-31G(D) LANL2DZ GENECP-4320.07227433; Eh
thumbnail.jpeg20-Jul-2022/TA_TT_energy_study Bach_iPr_TT_TS1_IGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRB3LYPGENECP-1760.04747621; Eh
thumbnail.jpeg20-Jul-2022/Davies_Me Davies_Me_CA_TS1Guo, WentaoGaussian; 09; AM64L-G09RevD.01Single point MinimumRB3LYPGENECP-4355.95318301; Eh
thumbnail.jpeg20-Jul-2022/fDavies_Ph fDavies_Ph_CT_TS1Guo, WentaoGaussian; 16; ES64L-G16RevA.03Single point StructureRB3LYPGENECP-14577.8685222; Eh
thumbnail.jpeg20-Jul-2022/Bach_iPr_system Bach_iPr_TA_VTS1Guo, WentaoGaussian; 16; ES64L-G16RevC.01Single point StructureRB3LYPGENECP-4320.06430740; Eh
Results 41-50 of 69 (Search time: 0.001 seconds).