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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg30-Aug-2018small_basis_A-3-I_cis-NiIPhITMe2_sqpMaseras, FeliuGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G*-1179.48232297; Eh
thumbnail.jpeg30-Aug-2018small_basis_A-5-I_NiITMe2IPhMaseras, FeliuGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G*-1179.39175512; Eh
thumbnail.jpeg30-Aug-2018small_basis_IPhen_IPhenMaseras, FeliuGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(d)-688.305264293; Eh
thumbnail.jpeg30-Aug-2018small_basis_PhBr_PhBr_gMaseras, FeliuGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G*-244.832457648; Eh
thumbnail.jpeg30-Aug-2018small_basis_PhI_PhI_gMaseras, FeliuGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G*-243.043279113; Eh
thumbnail.jpeg30-Aug-2018small_basis_THF_THF_gMaseras, FeliuGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G*-232.459004827; Eh
thumbnail.jpeg30-Aug-2018small_basis_A-4-Br_NiBrPhITMe2Maseras, FeliuGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G*-1181.27264308; Eh
thumbnail.jpeg30-Aug-2018small_basis_A-4-I_NiIPhITMe2Maseras, FeliuGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G*-1179.49143667; Eh
thumbnail.jpeg30-Aug-2018small_basis_NiCODIXy_NiCODIXyMaseras, FeliuGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G*-1327.03087490; Eh
thumbnail.jpeg30-Aug-2018small_basis_TS-B-2x-3x-Cl_NiIMes_e2PhCl_1_scanCCl_s9tsMaseras, FeliuGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYP6-31G*-1785.45272755; Eh
Results 31-40 of 116 (Search time: 0.001 seconds).