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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg29-Oct-2019ts_b_to_b_hemicarbGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB97D36-311G(D,P)-3226.43554734; Eh
thumbnail.jpeg29-Oct-2019am_alkoxideGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G(D,P)-3037.89007616; Eh
thumbnail.jpeg29-Oct-2019am_hemicarbGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G(D,P)-3226.45200875; Eh
thumbnail.jpeg29-Oct-2019bromideGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G(D,P)-2575.60499591; Eh
thumbnail.jpeg29-Oct-2019co2Garay Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G(D,P)-188.536756131; Eh
thumbnail.jpeg29-Oct-2019conc_ts_to_b2hemicarbGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB97D36-311G(D,P)-3226.42651216; Eh
thumbnail.jpeg29-Oct-2019ts_b2_cyclGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB97D36-311G(D,P)-3226.43484388; Eh
thumbnail.jpeg29-Oct-2019ts2_b2_alkGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB97D36-311G(D,P)-3037.87713815; Eh
thumbnail.jpeg29-Oct-2019ts_conc_to_a_hemicarbGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB97D36-311G(D,P)-3226.43382560; Eh
thumbnail.jpeg29-Oct-2019b_alkoxideGaray Ruiz, DiegoGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB97D36-311G(D,P)-3037.88813471; Eh
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