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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg4-Jun-2018TS19-20FArtus Suarez, LluisGaussian; 09; ES64L-G09RevD.01Geometry optimization TSRM066-31+G**-2408.27243811; Eh
thumbnail.jpeg4-Jun-2018TS02-03Artus Suarez, LluisGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM066-31+G**-2006.36996758; Eh
thumbnail.jpeg4-Jun-201821DMFArtus Suarez, LluisGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM066-31+G**-2255.92882216; Eh
thumbnail.jpeg4-Jun-2018TS11-12DMFArtus Suarez, LluisGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM066-31+G**-650.245134773; Eh
thumbnail.jpeg4-Jun-201807FArtus Suarez, LluisGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM066-31+G**-2007.57755892; Eh
thumbnail.jpeg4-Jun-201809FArtus Suarez, LluisGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM066-31+G**-2007.56014912; Eh
thumbnail.jpeg4-Jun-2018Hemiaminal_FArtus Suarez, LluisGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM066-31+G**-401.881982428; Eh
thumbnail.jpeg4-Jun-2018DimethylamineArtus Suarez, LluisGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM066-31+G**-135.070343757; Eh
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