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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg15-Oct-20182_6-OPBEFernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUOPBE6-31+g(d)-1361.82207693; Eh
thumbnail.jpeg15-Oct-20183_2-OPBEFernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUOPBE6-31+g(d)-1361.82385699; Eh
thumbnail.jpeg15-Oct-20183_4-OPBEFernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUOPBE6-31+g(d)-1361.80941188; Eh
thumbnail.jpeg15-Oct-2018NCCH2-OPBEFernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUOPBE6-31+g(d)-132.045253953; Eh
thumbnail.jpeg15-Oct-20183_6-OPBEFernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUOPBE6-31+g(d)-1361.82207226; Eh
thumbnail.jpeg15-Oct-20184_2-OPBEFernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUOPBE6-31+g(d)-1361.82370357; Eh
thumbnail.jpeg15-Oct-20184_4-OPBEFernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUOPBE6-31+g(d)-1361.81862165; Eh
thumbnail.jpeg15-Oct-2018O2-t-OPBEFernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUOPBE6-31+g(d)-150.268525957; Eh
thumbnail.jpeg15-Oct-20184_6-OPBEFernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUOPBE6-31+g(d)-1361.80848338; Eh
thumbnail.jpeg15-Oct-20186_2-OPBEFernández, VíctorGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUOPBE6-31+g(d)-1247.41549619; Eh
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