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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg23-Dec-2023/SO2Ph_CO2Bn_Comparison INT2_3Wang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumUwB97XDDEF2TZVP-1833.11767492; Eh
thumbnail.jpeg23-Dec-2023/SO2Ph_CO2Bn_Comparison INT2_1Wang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumUwB97XDDEF2TZVP-1833.08964080; Eh
thumbnail.jpeg23-Dec-2023/SO2Ph_CO2Bn_Comparison INT5_3Wang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumUwB97XDDEF2TZVP-1512.37216686; Eh
thumbnail.jpeg23-Dec-2023/SO2Ph_CO2Bn_Comparison INT5_1Wang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumUwB97XDDEF2TZVP-1512.34510746; Eh
thumbnail.jpeg23-Dec-2023/SO2Ph_CO2Bn_Comparison TS_1_3Wang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization TSUwB97XDDEF2TZVP-1833.07382977; Eh
thumbnail.jpeg23-Dec-2023/SO2Ph_CO2Bn_Comparison TS_1_1Wang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization TSUwB97XDDEF2TZVP-1833.06182902; Eh
thumbnail.jpeg23-Dec-2023/SO2Ph_CO2Bn_Comparison SF5_RadicalWang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumUwB97XDDEF2TZVP-897.404494084; Eh
thumbnail.jpeg23-Dec-2023/SO2Ph_CO2Bn_Comparison TS_6_3Wang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization TSUwB97XDDEF2TZVP-1512.32498453; Eh
thumbnail.jpeg23-Dec-2023/SO2Ph_CO2Bn_Comparison TS_6_1Wang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization TSUwB97XDDEF2TZVP-1512.32410969; Eh
thumbnail.jpeg23-Dec-2023/SO2Ph_CO2Bn_Comparison 35Wang-Yeuk, KongGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumUwB97XDDEF2TZVP-935.666741316; Eh
Results 11-20 of 43 (Search time: 0.001 seconds).