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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg3-Feb-2017A_gasFernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRM062X--615.630458379; Eh
thumbnail.jpeg3-Feb-2017TS2_gasFernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization TSONIOM; M062X; UFF--983.258099066; Eh
thumbnail.jpeg3-Feb-2017Water_solvFernández, VíctorGaussian; 09; EM64L-G09RevA.02Single point StructureRM062X--76.4253004768; Eh
thumbnail.jpeg3-Feb-2017TS3-H2O_gasFernández, VíctorGaussian; 09; EM64L-G09RevD.01Single point StructureONIOM; M062X; UFF--983.303119139; Eh
thumbnail.jpeg3-Feb-2017F_gasFernández, VíctorGaussian; 09; EM64L-G09RevD.01Single point MinimumONIOM; M062X; UFF--983.330405137; Eh
thumbnail.jpeg3-Feb-2017D_solventFernández, VíctorGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X--1968.88215506; Eh
thumbnail.jpeg3-Feb-2017TS1-H2O_solventFernández, VíctorGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X--2045.23493578; Eh
thumbnail.jpeg3-Feb-2017TS2_solventFernández, VíctorGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X--1968.78699666; Eh
thumbnail.jpeg3-Feb-2017C_gasFernández, VíctorGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X--1352.92390868; Eh
thumbnail.jpeg3-Feb-2017TS3-H2O_solventFernández, VíctorGaussian; 09; EM64L-G09RevD.01Single point StructureRM062X--1968.82808174; Eh
Results 11-20 of 244 (Search time: 0.001 seconds).