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PreviewTitleAuthor(s)ProgramMethod(s)Basis SetEnergySolv.Vibr.
thumbnail.jpegfragSR2OHax_B3LYP_6-31plGdp_PCM_ener_opt_freqVan der Kamp, MarcGaussian; 09; ES64L-G09RevD.01RB3LYP6-31+G(D,P)-803.788800875; Eh
thumbnail.jpegfragSR2OHeq_B3LYP_6-31plGdp_PCM_ener_opt_freqVan der Kamp, MarcGaussian; 09; ES64L-G09RevD.01RB3LYP6-31+G(D,P)-803.789553820; Eh
thumbnail.jpegfragSS2OHax_B3LYP_6-31plGdp_PCM_ener_opt_freqVan der Kamp, MarcGaussian; 09; ES64L-G09RevD.01RB3LYP6-31+G(D,P)-803.784472117; Eh
thumbnail.jpegfragSS2OHeq_B3LYP_6-31plGdp_PCM_ener_opt_freqVan der Kamp, MarcGaussian; 09; ES64L-G09RevD.01RB3LYP6-31+G(D,P)-803.787632625; Eh
thumbnail.jpegfragRR2OHax_B3LYP_6-31plGdp_PCM_ener_opt_freqVan der Kamp, MarcGaussian; 09; ES64L-G09RevD.01RB3LYP6-31+G(D,P)-803.791514210; Eh
thumbnail.jpegfragRR2OHeq_B3LYP_6-31plGdp_PCM_ener_opt_freqVan der Kamp, MarcGaussian; 09; ES64L-G09RevD.01RB3LYP6-31+G(D,P)-803.786045333; Eh
thumbnail.jpegfragRS2OHax_B3LYP_6-31plGdp_PCM_ener_opt_freqVan der Kamp, MarcGaussian; 09; ES64L-G09RevD.01RB3LYP6-31+G(D,P)-803.785922021; Eh
thumbnail.jpegfragRS2OHeq_B3LYP_6-31plGdp_PCM_ener_opt_freqVan der Kamp, MarcGaussian; 09; ES64L-G09RevD.01RB3LYP6-31+G(D,P)-803.782238082; Eh
thumbnail.jpegfragSR2OHax_MP2_6-31plGdp_PCM_ener_freqVan der Kamp, MarcGaussian; 09; ES64L-G09RevD.01RMP2-FC6-31+G(D,P)-799.090314983; Eh
thumbnail.jpegfragSR2OHeq_MP2_6-31plGdp_PCM_ener_freqVan der Kamp, MarcGaussian; 09; ES64L-G09RevD.01RMP2-FC6-31+G(D,P)-799.088186984; Eh
thumbnail.jpegfragSS2OHax_MP2_6-31plGdp_PCM_ener_freqVan der Kamp, MarcGaussian; 09; ES64L-G09RevD.01RMP2-FC6-31+G(D,P)-799.083523658; Eh
thumbnail.jpegfragSS2OHeq_MP2_6-31plGdp_PCM_ener_freqVan der Kamp, MarcGaussian; 09; ES64L-G09RevD.01RMP2-FC6-31+G(D,P)-799.087030492; Eh
thumbnail.jpegfragRR2OHax_MP2_6-31plGdp_PCM_ener_freqVan der Kamp, MarcGaussian; 09; ES64L-G09RevD.01RMP2-FC6-31+G(D,P)-799.090628576; Eh
thumbnail.jpegfragRR2OHeq_MP2_6-31plGdp_PCM_ener_freqVan der Kamp, MarcGaussian; 09; ES64L-G09RevD.01RMP2-FC6-31+G(D,P)-799.084813340; Eh
thumbnail.jpegfragRS2OHax_MP2_6-31plGdp_PCM_ener_freqVan der Kamp, MarcGaussian; 09; ES64L-G09RevD.01RMP2-FC6-31+G(D,P)-799.086542994; Eh
thumbnail.jpegfragRS2OHeq_MP2_6-31plGdp_PCM_ener_freqVan der Kamp, MarcGaussian; 09; ES64L-G09RevD.01RMP2-FC6-31+G(D,P)-799.079706899; Eh
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