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/Common_Structures Succinimide_BpinWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062XDEF2SVP-770.507343368; Eh
Login required19-Sep-2022/Thiophene IM1B_primeWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062XDEF2SVP-3845.53185221; Eh
Login required19-Sep-2022/Thiophene IM3AWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062XDEF2SVP-4205.30368852; Eh
Login required19-Sep-2022/Thiophene IM2BWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062XDEF2SVP-4205.33118641; Eh
Login required19-Sep-2022/Thiophene IM2AWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062XDEF2SVP-4205.26501057; Eh
Login required19-Sep-2022/Thiophene IM1BWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062XDEF2SVP-4205.30216409; Eh
Login required19-Sep-2022/Thiophene P_transWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062XDEF2SVP-860.801576976; Eh
Login required19-Sep-2022/Thiophene P_cisWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062XDEF2SVP-860.795296332; Eh
Login required19-Sep-2022/Thiophene IM0Wang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062XDEF2SVP-1271.69896575; Eh
Login required19-Sep-2022/Thiophene TS3B_primeWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRM062XDEF2SVP-4205.30373289; Eh
Results 291-300 of 493 (Search time: 0.001 seconds).