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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg30-Jan-2019/Solv_Opt/M06_2x/TS2 TS2González Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X6-311G**-1690.50361890; Eh
thumbnail.jpeg30-Jan-2019/Solv_Opt/M06_2x/TS_isom TS_isomGonzález Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X6-311G**-1690.50463167; Eh
thumbnail.jpeg30-Jan-2019/Solv_Opt/M06_2x/TS1 TS1González Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X6-311G**-1501.90504820; Eh
thumbnail.jpeg30-Jan-2019/Solv_Opt/M06_2x/TS3 TS3González Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X6-311G**-1690.49440606; Eh
thumbnail.jpeg30-Jan-2019/Gas_Opt/M06_2X/TS_isom TS_isomGonzález Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X6-311G**-1690.41348352; Eh
thumbnail.jpeg30-Jan-2019/Gas_Opt/M06_2X/TS3 TS3González Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X6-311G**-1690.40908375; Eh
thumbnail.jpeg30-Jan-2019/Gas_Opt/M06_2X/TS1 TS1González Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X6-311G**-1501.81137603; Eh
thumbnail.jpeg30-Jan-2019/Gas_Opt/M06_2X/TS2 TS2González Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X6-311G**-1690.42452263; Eh
thumbnail.jpeg1-Dec-2017/Extra_Calculations/DFTAnalysis_Concerted_TS_CC/M062X/TS TSGonzález Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X--2103.15716984; Eh
Login required8-Oct-2019/Racemization/TMA_Cat/M06_2X/TS2 TS2González Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRM062X6-311G(D,P)-631.315715080; Eh
Results 1-10 of 13 (Search time: 0.002 seconds).