Reinterpreting the infrared spectrum of H + HCN: Methylene amidogen radical and its coproducts
Wiens, Avery E, Copan, Andreas V, Rossomme, Elliot C, Aroeira, Gustavo J R, Bernstein, Olivia M, Agarwal, Jay, Schaefer, Henry F
Published in The Journal of chemical physics (07.01.2018)
Published in The Journal of chemical physics (07.01.2018)
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Peroxyacetyl radical: electronic excitation energies, fundamental vibrational frequencies, and symmetry breaking in the first excited state
Copan, Andreas V, Wiens, Avery E, Nowara, Ewa M, Schaefer, 3rd, Henry F, Agarwal, Jay
Published in The Journal of chemical physics (07.02.2015)
Published in The Journal of chemical physics (07.02.2015)
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Journal Article
Multi-fidelity Gaussian process modeling for chemical energy surfaces
Wiens, Avery E., Copan, Andreas V., Schaefer, Henry F.
Published in Chemical physics letters (01.01.2019)
Published in Chemical physics letters (01.01.2019)
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