Reference Label | Details |
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est unc | estimated uncertainty |
Narendrapurapu 2011 | B. S. Narendrapurapu, A. C. Simmonett, H. F. Schaefer III, J. A. Miller, and S. J. Klippenstein, J. Phys. Chem. A 115, 14209-14214 (2011) Combustion Chemistry: Important Features of the C3H5 Potential Energy Surface, Including Allyl Radical, Propargyl + H2, Allene + H, and Eight Transition States |