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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg24-Feb-2020/PaperStructures/Minima WaterPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPCC-PVTZ-76.4666514750; Eh
thumbnail.jpeg11-Feb-2022TpBr3CuN_SiH_s_v1Pérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLANL2DZ 6-31G(D,P) GEN-2487.64205569; Eh
thumbnail.jpeg11-Feb-2022TpBr3CuN_SiH_s_v2Pérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLANL2DZ 6-31G(D,P) GEN-2487.63721882; Eh
thumbnail.jpeg11-Feb-2022Me2PhSiHPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D,P) GEN-601.630460841; Eh
thumbnail.jpeg26-Dec-2022/Redox Cu1_heterocoupledPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-2343.11919932; Eh
thumbnail.jpeg26-Dec-2022/Redox LCu1HFIPPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-2058.91858131; Eh
thumbnail.jpeg26-Dec-2022/Redox LCu1APérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-1918.73698598; Eh
thumbnail.jpeg26-Dec-2022/Redox LCu1Pérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-1269.55539272; Eh
thumbnail.jpeg26-Dec-2022/NLE RRSPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-3612.72365510; Eh
thumbnail.jpeg26-Dec-2022/NLE RSRPérez-Soto, RaúlGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31G(D) LANL2DZ GENECP-3612.72568777; Eh
Results 61-70 of 192 (Search time: 0.001 seconds).