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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg30-May-2021/benchmarking/CAM_B3LYP_6_311+Gdp CODNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRCAM-B3LYP6-311+G(D,P) GENECP-311.9309316; Eh
thumbnail.jpeg30-May-2021/benchmarking/CAM_B3LYP_D3BJ_6_311+Gdp NiCODdppfNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRCAM-B3LYP6-311+G(D,P) GENECP-5079.0438319; Eh
thumbnail.jpeg30-May-2021/benchmarking/CAM_B3LYP_D3_6_311+Gdp NiCODdppfNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRCAM-B3LYP6-311+G(D,P) GENECP-5078.9991918; Eh
thumbnail.jpeg30-May-2021/benchmarking/CAM_B3LYP_D3_6_311+Gdp Nidppf2Nelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRCAM-B3LYP6-311+G(D,P) GENECP-8025.6993856; Eh
thumbnail.jpeg30-May-2021/benchmarking/CAM_B3LYP_6_311+Gdp NiCODdppfNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRCAM-B3LYP6-311+G(D,P) GENECP-5078.8885139; Eh
thumbnail.jpeg30-May-2021/benchmarking/CAM_B3LYP_6_311+Gdp Nidppf2Nelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRCAM-B3LYP6-311+G(D,P) GENECP-8025.4975393; Eh
thumbnail.jpeg30-May-2021/benchmarking/CAM_B3LYP_D3_6_311+Gdp dppfNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRCAM-B3LYP6-311+G(D,P) GENECP-3258.61794; Eh
thumbnail.jpeg30-May-2021/benchmarking/CAM_B3LYP_6_311+Gdp dppfNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRCAM-B3LYP6-311+G(D,P) GENECP-3258.5522381; Eh
thumbnail.jpeg30-May-2021/benchmarking/CAM_B3LYP_D3BJ_6_311+Gdp CODNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRCAM-B3LYP6-311+G(D,P) GENECP-311.9466062; Eh
thumbnail.jpeg30-May-2021/benchmarking/CAM_B3LYP_D3_6_311+Gdp CODNelson, DavidGaussian; 16; AM64L-G16RevA.03Single point StructureRCAM-B3LYP6-311+G(D,P) GENECP-311.9417672; Eh
Results 1-10 of 12 (Search time: 0.001 seconds).