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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg29-Feb-2016Int3b2-trans-solvGonzález Fabra, JoanGaussian; 09; EM64L-G09RevD.01Single point StructureRB97D36-311G**-2652.79636064; Eh
thumbnail.jpeg29-Feb-2016Int2a1-trans-solvGonzález Fabra, JoanGaussian; 09; EM64L-G09RevD.01Single point StructureRB97D36-311G**-1998.51745187; Eh
thumbnail.jpeg29-Feb-2016TS2a1-trans-solvGonzález Fabra, JoanGaussian; 09; EM64L-G09RevD.01Single point StructureRB97D36-311G**-1998.51543041; Eh
thumbnail.jpeg29-Feb-2016Int4b-trans-solvGonzález Fabra, JoanGaussian; 09; EM64L-G09RevD.01Single point StructureRB97D36-311G**-2652.78016440; Eh
thumbnail.jpeg29-Feb-2016TS4b-trans-solvGonzález Fabra, JoanGaussian; 09; EM64L-G09RevD.01Single point StructureRB97D36-311G**-2652.77192740; Eh
thumbnail.jpeg29-Feb-2016Int4b-transGonzález Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G**-2652.71858804; Eh
thumbnail.jpeg29-Feb-2016TS4b-transGonzález Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization StructureRB97D36-311G**-2652.71469286; Eh
thumbnail.jpeg29-Feb-2016Int3b2-transGonzález Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G**-2652.74135845; Eh
thumbnail.jpeg29-Feb-2016Int4b-cisGonzález Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G**-2652.73233618; Eh
thumbnail.jpeg29-Feb-2016Scan4b-transGonzález Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization Structure-6-31G*-2651.97964347; Eh
Results 31-40 of 1579 (Search time: 0.003 seconds).