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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required18-Apr-2017/B3LYP-D3 TS3_bisMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLanL2DZ; 6-311G**-1616.85163373; Eh
Login required18-Apr-2017/B3LYP-D3 TS1_monoMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLanL2DZ; 6-311G**-962.059741376; Eh
Login required18-Apr-2017/B3LYP TS3_bisMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLanL2DZ; 6-311G**-1616.78796356; Eh
Login required18-Apr-2017/B3LYP-D3 TS_form_addMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYP--1056.15983896; Eh
Login required18-Apr-2017/B3LYP-D3 TS2_adduct_monoMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLanL2DZ; 6-311G**-2018.34444612; Eh
Login required18-Apr-2017/B3LYP-D3 TS-iso2_bisMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLanL2DZ; 6-311G**-1616.80718155; Eh
Login required18-Apr-2017/B3LYP TS-iso1_monoMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLanL2DZ; 6-311G**-962.099590965; Eh
Login required18-Apr-2017/B3LYP TS1_monoMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLanL2DZ; 6-311G**-962.035012493; Eh
Login required18-Apr-2017/B3LYP-D3 TS2_without_OPh_bisMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLanL2DZ; 6-311G**-2010.18449618; Eh
Login required18-Apr-2017/B3LYP-D3 TS3_monoMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLanL2DZ; 6-311G**-1155.61414531; Eh
Results 21-30 of 30 (Search time: 0.001 seconds).