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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg15-Jan-2020/G09/UO2_2OH_xH2O/UO2_3H2O UO2_3H2OPetrus, EnricGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31+G* SDD GEN-1008.68549771; Eh
thumbnail.jpeg15-Jan-2020/G09/UO2_2OH_xH2O/UO2_H2O UO2_H2OPetrus, EnricGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-31+G* SDD GEN-855.799503896; Eh
thumbnail.jpeg15-Jan-2020/G09/UO2_OH_NO3_xH2O/UO2_H2O UO2_H2OPetrus, EnricGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-31+G* SDD GEN-1060.2937202; Eh
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