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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required30-Oct-2023/Opt IV_c12Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-1123.41926933; Eh
Login required30-Oct-2023/Opt IV_c13Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-1123.41788243; Eh
Login required30-Oct-2023/Opt IV_c14Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-1123.41752433; Eh
Login required30-Oct-2023/Opt IV_c20Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-1123.41626428; Eh
Login required30-Oct-2023/Opt IV_c19Sharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-1123.41588269; Eh
Login required30-Oct-2023/Single_Point I_c2_SPSharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ GENECP-1124.5902086; Eh
Login required30-Oct-2023/Single_Point I_c4_SPSharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ GENECP-1124.5896298; Eh
Login required30-Oct-2023/Single_Point I_c1_SPSharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ GENECP-1124.5908104; Eh
Login required30-Oct-2023/Single_Point I_c3_SPSharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ GENECP-1124.5895931; Eh
Login required30-Oct-2023/Single_Point I_SPSharma, Akhilesh KumarGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPCC-PVTZ GENECP-1124.5919415; Eh
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