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Showing results 228 to 247 of 5241 < previous   next >
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required21-May-2019A1Artigas, AlbertGaussian; 09; ES64L-G09RevE.01Single point StructureRM06Lcc-pVTZ-3674.5569707; Eh
thumbnail.jpeg27-Jul-2021A1vila, jordiGaussian; 16; ES64L-G16RevA.03Single point StructureRM06LCC-PVTZ GEN-3092.317148; Eh
thumbnail.jpeg26-Oct-2022A1vila, jordiGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDCC-PVTZ GEN-5001.6800311; Eh
thumbnail.jpeg27-Feb-2024A1diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-2767.82055848; Eh
Login required18-Oct-2023A1diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-2767.82055848; Eh
thumbnail.jpeg27-Feb-2024A1diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-2767.82055848; Eh
Login required18-Oct-2023A10diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-3804.33040362; Eh
thumbnail.jpeg27-Feb-2024A10diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-3804.33560176; Eh
thumbnail.jpeg27-Feb-2024A10diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-3804.33560176; Eh
thumbnail.jpeg27-Feb-2024A11diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-2644.57753104; Eh
thumbnail.jpeg27-Feb-2024A11diaz, alexGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPCC-PVDZ GEN-2644.57753104; Eh
thumbnail.jpeg26-Oct-2022A1_1vila, jordiGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDCC-PVTZ GEN-5001.6774743; Eh
thumbnail.jpeg26-Oct-2022A1_Pvila, jordiGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDCC-PVTZ GEN-5534.7956082; Eh
thumbnail.jpeg26-Oct-2022A1_P_1Bvila, jordiGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDCC-PVTZ GEN-5534.796387; Eh
thumbnail.jpeg26-Oct-2022A1_PPvila, jordiGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDCC-PVTZ GEN-5534.7917358; Eh
thumbnail.jpeg26-Oct-2022A1_PP_1Bvila, jordiGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDCC-PVTZ GEN-5534.7951951; Eh
thumbnail.jpeg26-Oct-2022A1_PP_1Cvila, jordiGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDCC-PVTZ GEN-5534.7895534; Eh
thumbnail.jpeg26-Oct-2022A1_PP_1Dvila, jordiGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDCC-PVTZ GEN-5534.7933174; Eh
thumbnail.jpeg26-Oct-2022A1_PP_2Avila, jordiGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDCC-PVTZ GEN-5534.7887964; Eh
thumbnail.jpeg26-Oct-2022A1_PP_2Bvila, jordiGaussian; 16; ES64L-G16RevA.03Single point StructureRwB97XDCC-PVTZ GEN-5534.7956547; Eh
Showing results 228 to 247 of 5241 < previous   next >