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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required18-Oct-2023TSA10A11diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPCC-PVDZ GEN-3804.33608762; Eh
Login required18-Oct-2023TSA1A2diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPCC-PVDZ GEN-2767.79161163; Eh
Login required18-Oct-2023A5diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-3060.33799171; Eh
Login required18-Oct-20231adiaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ-1160.79568426; Eh
Login required18-Oct-2023A9diaz, alexGaussian; 16; ES64L-G16RevA.03Single point StructureRB3LYPCC-PVDZ-1160.90166426; Eh
Login required18-Oct-2023TSA1A2primdiaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRB3LYPCC-PVDZ GEN-2767.78475570; Eh
Login required18-Oct-2023A3primdiaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-2767.85053876; Eh
Login required18-Oct-2023Wilkinson1Pdiaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-1606.90707037; Eh
Login required18-Oct-2023A1Primdiaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-2767.81691774; Eh
Login required18-Oct-2023B6diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-2767.91379696; Eh
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