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PreviewTitleAuthor(s)ProgramMethod(s)Basis SetEnergySolv.Vibr.
thumbnail.jpeg2a_ASharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* SDD GENECP-886.079766028; Eh
thumbnail.jpeg2aSharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* SDD GENECP-1826.83284257; Eh
thumbnail.jpegIArSharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYPGENECP-470.962475033; Eh
thumbnail.jpegHPF₆Sharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYPGEN-941.111235095; Eh
thumbnail.jpegHFSharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYPGEN-100.423110602; Eh
thumbnail.jpegPF₆-Sharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYPGEN-940.721132902; Eh
thumbnail.jpegN₂Sharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYPGEN-109.521834845; Eh
thumbnail.jpeg1aSharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* GENECP-576.878141924; Eh
thumbnail.jpeg3aSharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* GENECP-882.182063728; Eh
thumbnail.jpegBSharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* SDD GENECP-3893.84611038; Eh
thumbnail.jpegC_N2Sharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* SDD GENECP-3893.84822290; Eh
thumbnail.jpegC_ASharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* SDD GENECP-2843.56166361; Eh
thumbnail.jpegCSharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* SDD GENECP-3784.32631013; Eh
thumbnail.jpegC₁Sharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* SDD GENECP-4361.23774010; Eh
thumbnail.jpegDSharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* SDD GENECP-4361.25713665; Eh
thumbnail.jpegC_c1Sharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* SDD GENECP-4361.23666769; Eh
thumbnail.jpegC₂Sharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYPGENECP-4361.23169709; Eh
thumbnail.jpegD₃Sharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* SDD GENECP-2949.51513438; Eh
thumbnail.jpegC_1ASharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* SDD GENECP-3420.47648643; Eh
thumbnail.jpegD₁Sharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* SDD GENECP-3420.49670788; Eh
thumbnail.jpegC2ASharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* SDD GENECP-3420.46910464; Eh
thumbnail.jpegD₂Sharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* SDD GENECP-3420.51133402; Eh
thumbnail.jpegFSharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* SDD GENECP-1353.53985109; Eh
thumbnail.jpegTS3_PRCSharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* SDD GENECP-2949.11552358; Eh
thumbnail.jpegTS3_ProdSharma, Akhilesh KumarGaussian; 16; AM64L-G16RevA.03RB3LYP6-31G* SDD GENECP-2949.17460618; Eh
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