Search        

Current filters:
Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required19-Sep-2022/Furan_Cyc TS1BWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRM062XDEF2SVP-3768.03778044; Eh
Login required19-Sep-2022/Indole_NBS IM0Wang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062XDEF2SVP-1121.68406652; Eh
Login required19-Sep-2022/Indole_I2 IM2AWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062XDEF2SVP-2312.29478646; Eh
Login required19-Sep-2022/Indole_I2 IM1BWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062XDEF2SVP-2312.33255955; Eh
Login required19-Sep-2022/Indole_I2 IM0BWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062XDEF2SVP-2312.23215233; Eh
Login required19-Sep-2022/Indole_I2 IM1AWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062XDEF2SVP-2312.25009134; Eh
Login required19-Sep-2022/Indole_NBS TS1BWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRM062XDEF2SVP-4055.17915621; Eh
Login required19-Sep-2022/Indole_NBS TS2AWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Single point StructureRM062XDEF2SVP-4055.19026579; Eh
Login required19-Sep-2022/Indole_I2 TS0BWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRM062XDEF2SVP-2312.22052709; Eh
Login required19-Sep-2022/Indole_I2 TS1AWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRM062XDEF2SVP-2312.21932724; Eh
Results 341-350 of 493 (Search time: 0.001 seconds).