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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg19-Apr-2018TS10-11Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-2993.89453899; Eh
thumbnail.jpeg19-Apr-20189Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-2646.33880809; Eh
thumbnail.jpeg19-Apr-20188Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-2646.35032480; Eh
thumbnail.jpeg19-Apr-201810Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-2993.91498325; Eh
thumbnail.jpeg19-Apr-201813Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-2226.89862742; Eh
thumbnail.jpeg19-Apr-20185Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-1651.63131080; Eh
thumbnail.jpeg19-Apr-201812Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-2993.96097200; Eh
thumbnail.jpeg19-Apr-201811Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-2993.94930150; Eh
thumbnail.jpeg19-Apr-2018CuOAc2_dimer_TFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureUB97D6-311++G**-1459.99328122; Eh
thumbnail.jpeg19-Apr-201812-RhIIFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB97DLANL2DZ; 6-31G*-763.343446901; Eh
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