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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-May-2016PdII_Cl_O2_ROHJover Modrego, JesúsGaussian; 09; EM64L-G09RevA.02Geometry optimization MinimumRPBEPBE6-31+G*; SDD-970.500473921; Eh
thumbnail.jpeg9-May-2016PdII_Cl2_2OHJover Modrego, JesúsGaussian; 09; EM64L-G09RevA.02Geometry optimization MinimumRPBEPBE6-31+G*; SDD-1199.78894039; Eh
thumbnail.jpeg9-May-2016H2O2Jover Modrego, JesúsGaussian; 09; EM64L-G09RevA.02Geometry optimization MinimumRPBEPBE--151.411054333; Eh
thumbnail.jpeg9-May-2016ROJover Modrego, JesúsGaussian; 09; EM64L-G09RevA.02Geometry optimization MinimumRPBEPBE--230.961473784; Eh
thumbnail.jpeg9-May-2016PdII_Cl_OH_ORJover Modrego, JesúsGaussian; 09; EM64L-G09RevA.02Geometry optimization MinimumRPBEPBE6-31+G*; SDD-895.419878844; Eh
thumbnail.jpeg9-May-2016Pd3OAc6Jover Modrego, JesúsGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE6-31+G*; SDD-1753.39112709; Eh
thumbnail.jpeg9-May-2016PdOAc2Jover Modrego, JesúsGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRPBEPBE6-31+G*; SDD-584.434763784; Eh
thumbnail.jpeg9-May-2016PdCl2Jover Modrego, JesúsGaussian; 09; EM64L-G09RevA.02Geometry optimization MinimumRPBEPBE6-31+G*; SDD-1048.26575163; Eh
thumbnail.jpeg9-May-2016ROHJover Modrego, JesúsGaussian; 09; EM64L-G09RevA.02Geometry optimization MinimumRPBEPBE--232.146975576; Eh
thumbnail.jpeg9-May-2016PdII_Cl_2OH_ROHJover Modrego, JesúsGaussian; 09; EM64L-G09RevA.02Geometry optimization MinimumRPBEPBE6-31+G*; SDD-971.784100730; Eh
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