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.jpeg9-Nov-2022/enamine/DCM 1c_DCMGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X6-31G(D)-1885.64839777; Eh
thumbnail.jpeg9-Nov-2022/enamine/DCM INT1c_DCMGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X6-31G(D)-1885.62949465; Eh
thumbnail.jpeg9-Nov-2022/enamine/DCM 3c_DCMGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X6-31G(D)-1885.67551994; Eh
thumbnail.jpeg9-Nov-2022/enamine/DCM INT2c_DCMGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X6-31G(D)-1885.62573187; Eh
thumbnail.jpeg9-Nov-2022TS1_TGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUPBE1PBEDEF2SVP-3360.95501805; Eh
thumbnail.jpeg9-Nov-2022IM2_SGuo, WentaoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRPBE1PBEDEF2SVP-3360.94964856; Eh
thumbnail.jpeg9-Nov-2022/model IGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X6-31G(D)-1218.74322952; Eh
thumbnail.jpeg9-Nov-2022/model IIGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X6-31G(D)-1218.77975161; Eh
thumbnail.jpeg9-Nov-2022/enone 1aGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X6-31G(D)-1826.92580124; Eh
thumbnail.jpeg9-Nov-2022/enone 2aGuo, WentaoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRM062X6-31G(D)-1826.95671352; Eh
Results 1-10 of 363 (Search time: 0.001 seconds).