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PreviewTitleAuthor(s)ProgramMethod(s)Basis SetEnergySolv.Vibr.
thumbnail.jpegsmall_basis_B-4-Br_NiBrPhIMes2Maseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-2262.81263762; Eh
thumbnail.jpegsmall_basis_A-4-Cl_NiClPhITMe2Maseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-1628.28851585; Eh
thumbnail.jpegsmall_basis_A-6-I_NiIITMe2Maseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-31G*-947.830284938; Eh
thumbnail.jpegsmall_basis_NiCODITMe_NiITMeCODMaseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-864.894348417; Eh
thumbnail.jpegsmall_basis_B-3x-Cl_NiClPhIMes_3Maseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-1785.53293647; Eh
thumbnail.jpegsmall_basis_B-5-I_NiIMes2_IPh_2001_r2Maseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-2260.95413771; Eh
thumbnail.jpegsmall_basis_A-3-Cl_cis-NiClPhITMe2_sqpMaseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-1628.28145589; Eh
thumbnail.jpegsmall_basis_B-4-Cl_NiClPhIMes2Maseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-2709.83537734; Eh
thumbnail.jpegsmall_basis_NiCODIXy_NiCODIXyMaseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-1327.03087490; Eh
thumbnail.jpegsmall_basis_A-6-Cl_NiClITMe2Maseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-31G*-1396.62463677; Eh
thumbnail.jpegsmall_basis_A-1_NiITMe2_isom2Maseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-936.329152812; Eh
thumbnail.jpegsmall_basis_NiCODIPhen_NiCODIPhenMaseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G(d)-1169.74676374; Eh
thumbnail.jpegsmall_basis_B-2x-Cl_NiIMes_e2PhCl_1Maseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-1785.46267268; Eh
thumbnail.jpegsmall_basis_A-5-Br_NiITMe2BrPh_2Maseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-1181.17022003; Eh
thumbnail.jpegsmall_basis_C-3-Cl_tetNiClPhIXy2Maseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-2552.50973796; Eh
thumbnail.jpegsmall_basis_B-1_NiIMes2_rMaseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-2017.88811766; Eh
thumbnail.jpegsmall_basis_D-5-Cl_NiIPhen2_ClPhMaseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-2237.88504362; Eh
thumbnail.jpegsmall_basis_PhH_benzene_gecpMaseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-232.256361877; Eh
thumbnail.jpegsmall_basis_B-4-I_NiIPhIMes2Maseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-2261.02616171; Eh
thumbnail.jpegsmall_basis_B-2-Br_NiIMes2_PhBr_OATS_fromCl_ts_ircrev_0p5Maseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-2262.71531935; Eh
thumbnail.jpegsmall_basis_B-5-Cl_NiIMes2_ClPh_fromBr_t_ossts_ircrev_t_optMaseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-31G*-2709.75023475; Eh
thumbnail.jpegsmall_basis_B-6-Cl_NiClIMes2Maseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-31G*-2478.18155136; Eh
thumbnail.jpegsmall_basis_B-6-Br_NiBrIMes2Maseras, FeliuGaussian; 09; EM64L-G09RevD.01UB3LYP6-31G*-2031.16374362; Eh
thumbnail.jpegsmall_basis_NiCODIMes_B-1x_NiIMesCODMaseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-1405.67243881; Eh
thumbnail.jpegsmall_basis_COD_COD_twistboat_gecpMaseras, FeliuGaussian; 09; EM64L-G09RevD.01RB3LYP6-31G*-312.045740768; Eh
Results 1-25 of 63 (Search time: 0.047 seconds).