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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg13-Jul-2018/B3LYPD3_calculations c9Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-1779.18657607; Eh
thumbnail.jpeg13-Jul-2018/B3LYPD3_calculations c3Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-1589.08044526; Eh
thumbnail.jpeg13-Jul-2018/B3LYPD3_calculations 2Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYP6-311++G**-615.810870096; Eh
thumbnail.jpeg13-Jul-2018/B3LYPD3_calculations c5-O2-S-HFunes-Ardoiz, Ignacio-Single point Structure---
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