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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg13-Jul-2018TS10t-11t-C2Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-3434.52071700; Eh
thumbnail.jpeg13-Jul-2018C6H6RuCl2_dimerFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB97D6-311++G**-2493.62212413; Eh
thumbnail.jpeg13-Jul-2018TS2t-3tFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-1824.36177801; Eh
thumbnail.jpeg13-Jul-201814tFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-1383.53695788; Eh
thumbnail.jpeg13-Jul-2018TS19t-20tOAcFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-1607.95906336; Eh
thumbnail.jpeg13-Jul-2018TS19t-20tOHFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-1607.94480591; Eh
thumbnail.jpeg13-Jul-2018TS21t-22tFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-3434.51162515; Eh
thumbnail.jpeg13-Jul-20187tFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-3146.35830795; Eh
thumbnail.jpeg13-Jul-2018TS10t-11t-C3Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-3434.52735791; Eh
thumbnail.jpeg13-Jul-2018CuOAc2_dimerFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-1307.12793871; Eh
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