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PreviewTitleAuthor(s)ProgramMethod(s)Basis SetEnergySolv.Vibr.
thumbnail.jpeglarge_basis_A-6-I_NiIITMe2_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-948.038890059; Eh
thumbnail.jpeglarge_basis_A-6-Cl_NiClITMe2_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-1396.87288804; Eh
thumbnail.jpeglarge_basis_TS-B-5-6-Cl_NiIMes2_ossts_PhCl_t_oss_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-2710.32684219; Eh
thumbnail.jpeglarge_basis_TS-B-5-6-Cl_NiIMes2_ossts_PhCl_t_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-2710.30413986; Eh
thumbnail.jpeglarge_basis_TS-D-5-6-Cl_NiIPhen2_ossts_PhCl_t_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-2238.31537306; Eh
thumbnail.jpeglarge_basis_TS-D-5-6-Cl_NiIPhen2_ossts_PhCl_t_oss_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-2238.33779493; Eh
thumbnail.jpeglarge_basis_B-6-Cl_NiClIMes2_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-2478.70682012; Eh
thumbnail.jpeglarge_basis_B-6-Br_NiBrIMes2_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-2031.65228445; Eh
thumbnail.jpeglarge_basis_B-6-I_NiIIMes2_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-2029.87272324; Eh
thumbnail.jpeglarge_basis_A-6-Br_NiBrITMe2_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-949.818278044; Eh
thumbnail.jpeglarge_basis_THFrad_THFrad_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-231.874549871; Eh
thumbnail.jpeglarge_basis_TS-A-5-6-I_NiITMe2_IPh_ossts_t_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-1179.64172017; Eh
thumbnail.jpeglarge_basis_TS-A-5-6-I_NiITMe2_IPh_ossts_t_ts_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-1179.66802572; Eh
thumbnail.jpeglarge_basis_Phrad_Phrad_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-231.634154727; Eh
thumbnail.jpeglarge_basis_TS-B-5-6-Br_NiIMes2_ossts_PhBr_t_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-2263.26214208; Eh
thumbnail.jpeglarge_basis_TS-B-5-6-Br_NiIMes2_ossts_PhBr_t_oss_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-2263.28344836; Eh
thumbnail.jpeglarge_basis_TS-C-5-6-Cl_NiIXy2_ClPh_sptMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-2552.97818662; Eh
thumbnail.jpeglarge_basis_TS-C-5-6-Cl_NiIXy2_ClPh_spt_spsMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-2553.00094615; Eh
thumbnail.jpeglarge_basis_D-6-Cl_NiClIPhen2_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-2006.71966450; Eh
thumbnail.jpeglarge_basis_TS-A-5-6-Cl_NiITMe2_ossts_PhCl_t_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-1628.46336906; Eh
thumbnail.jpeglarge_basis_TS-A-5-6-Cl_NiITMe2_ossts_PhCl_t_oss_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-1628.48697466; Eh
thumbnail.jpeglarge_basis_TS-B-5-6-I_NiIMes2_ossts_PhI_t_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-2261.48124081; Eh
thumbnail.jpeglarge_basis_TS-B-5-6-I_NiIMes2_ossts_PhI_t_ossts_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-2261.50730351; Eh
thumbnail.jpeglarge_basis_TS-A-5-6-Br_NiITMe2_ossts_PhBr_t_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-1181.41909459; Eh
thumbnail.jpeglarge_basis_TS-A-5-6-Br_NiITMe2_ossts_PhBr_t_oss_bbMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-311+G(d,p)-1181.44251873; Eh
Results 1-25 of 47 (Search time: 0.025 seconds).