Search        

Current filters:
Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg20-Jul-2022/Bach_eth_system Bach_eth_trans_TS2Guo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPGENECP-4280.77041309; Eh
thumbnail.jpeg20-Jul-2022/fDavies_Ph fDavies_Ph_CT_TS2Guo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRB3LYPGENECP-14577.8788407; Eh
thumbnail.jpeg20-Jul-2022/TA_TT_energy_study Bach_iPr_TT_TS1_SiH3Guo, WentaoGaussian; 16; AS64L-G16RevC.01Geometry optimization TSRB3LYPGENECP-2039.96302181; Eh
thumbnail.jpeg20-Jul-2022/TA_TT_energy_study Bach_iPr_TT_TS1_MeGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPGENECP-1788.59038386; 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.jpeg9-Jan-2024/Rh2(s-dosp)4_system dosp_TS0_aabb2_cisGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRB3LYPGENECP-5625.18364187; Eh
thumbnail.jpeg9-Jan-2024/Rh2(s-dosp)4_system dosp_TS0_abbb_transGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRB3LYPGENECP-5625.16797090; Eh
thumbnail.jpeg6-Oct-2023/fDavies_Ph_correct_isomer fDavies_Ph_cis_iso_TS2Guo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRB3LYPGENECP-14577.8790084; Eh
thumbnail.jpeg6-Oct-2023/fDavies_Ph_correct_isomer fDavies_Ph_CT_iso_TS1Guo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRB3LYPGENECP-14577.8726319; Eh
thumbnail.jpeg6-Oct-2023/fDavies_Ph_correct_isomer fDavies_Ph_TT_iso_TS1Guo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRB3LYPGENECP-14577.8650826; Eh
Results 11-20 of 77 (Search time: 0.001 seconds).