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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required30-Oct-2023/Opt III_c2Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-1123.41820308; Eh
Login required30-Oct-2023/Opt III_c1Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-1123.42002677; Eh
Login required30-Oct-2023/Opt III_c4Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-1123.41883995; Eh
Login required30-Oct-2023/Opt III_c5Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-1123.41728584; Eh
Login required30-Oct-2023/Opt III_c3Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-1123.41729245; Eh
Login required30-Oct-2023/Opt III_c6Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-1123.41625795; Eh
Login required30-Oct-2023/Single_Point III_c15_SPSharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ GENECP-1124.5722592; Eh
Login required30-Oct-2023/Single_Point III_c16_SPSharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ GENECP-1124.5694496; Eh
Login required30-Oct-2023/Single_Point III_c18_SPSharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ GENECP-1124.5699778; Eh
Login required30-Oct-2023/Single_Point III_c17_SPSharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ GENECP-1124.5703118; Eh
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