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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg20-Jul-2022/fDavies_Ph fDavies_Ph_TT_TS2Guo, WentaoGaussian; 16; ES64L-G16RevB.01Single point StructureRB3LYPGENECP-14577.8843920; Eh
thumbnail.jpeg20-Jul-2022/Bach_eth_system Bach_eth_CT_TS1Guo, WentaoGaussian; 09; AM64L-G09RevD.01Single point MinimumRB3LYPGENECP-4280.75404494; Eh
thumbnail.jpeg20-Jul-2022/Davies_Ph Davies_Ph_CA_VTS1Guo, WentaoGaussian; 16; ES64L-G16RevA.03Single point StructureRB3LYPGENECP-4547.70312870; Eh
thumbnail.jpeg20-Jul-2022/Bach_iPr_system Bach_iPr_SMGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRB3LYPGENECP-1760.04747621; Eh
thumbnail.jpeg20-Jul-2022/TA_TT_energy_study Bach_iPr_TA_TS1_SiH3Guo, WentaoGaussian; 09; AM64L-G09RevD.01Geometry optimization TSRB3LYPGENECP-2039.96069488; Eh
thumbnail.jpeg20-Jul-2022/TA_TT_energy_study Bach_iPr_TA_TS1_CBr3Guo, WentaoGaussian; 09; AM64L-G09RevD.01Geometry optimization TSRB3LYPGENECP-9500.95671670; Eh
thumbnail.jpeg20-Jul-2022/fDavies_Ph fDavies_Ph_trans_lactoneGuo, WentaoGaussian; 16; ES64L-G16RevC.01Single point StructureRB3LYPGENECP-14577.9342630; Eh
thumbnail.jpeg20-Jul-2022/fDavies_Ph fDavies_Ph_CA_TS1Guo, WentaoGaussian; 16; ES64L-G16RevA.03Single point StructureRB3LYPGENECP-14577.8586183; Eh
thumbnail.jpeg20-Jul-2022/Rh2(s-TCPTTL)4 rh2stcpttl4_aaabGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRB3LYPGENECP-11163.2330458; Eh
thumbnail.jpeg20-Jul-2022/Rh2(s-TCPTTL)4 rh2stcpttl4_aaaaGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPGENECP-11163.2511410; Eh
Results 11-20 of 69 (Search time: 0.001 seconds).