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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg29-Oct-2019b_alkoxideGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G(D,P)-3037.88813471; Eh
thumbnail.jpeg29-Oct-2019isom_epoxideGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G(D,P)-462.296909838; Eh
thumbnail.jpeg29-Oct-2019am_alkoxideGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G(D,P)-3037.89007616; Eh
thumbnail.jpeg29-Oct-2019b2_hemicarbGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G(D,P)-3226.45986737; Eh
thumbnail.jpeg29-Oct-2019TMABrGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G(D,P)-2789.80988227; Eh
thumbnail.jpeg29-Oct-2019ta_syn_cis_cycGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G(D,P)-650.858077328; Eh
thumbnail.jpeg29-Oct-2019orig_epoxideGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G(D,P)-462.300782036; Eh
thumbnail.jpeg29-Oct-2019syn_cis_cycGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G(D,P)-650.867336092; Eh
thumbnail.jpeg29-Oct-2019b_hemicarbGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G(D,P)-3226.45181501; Eh
thumbnail.jpeg29-Oct-2019am_hemicarbGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G(D,P)-3226.45200875; Eh
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