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Article Dans Une Revue Combustion and Flame Année : 2024

Corrigendum to “A combined theoretical and experimental study of the pyrolysis of pyrrolidine”

Résumé

This corrigendum corrects the misidentified transition states from cyc-C2H5N to cis-HNCHCH3 and trans-HNCHCH3 (previously labeled as cis-TS5 and trans-TS5), which should correspond to the transition states from cis-HNCHCH3 and trans-HNCHCH3 to H2NCHCH2 in the corrected potential energy surface. The correct transition states from cyc-C2H5N to cis-HNCHCH3 and trans-HNCHCH3 are now defined as cis-TS13 and trans-TS13. Detailed geometries and frequencies of cis-TS13 and trans-TS13 can be found in the Supplementary Material.
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Dates et versions

hal-04654828 , version 1 (20-07-2024)

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Qifeng Hou, Wang Li, Jiabin Huang, Changyang Wang, Jiuzhong Yang, et al.. Corrigendum to “A combined theoretical and experimental study of the pyrolysis of pyrrolidine”. Combustion and Flame, 2024, 267, pp.113588. ⟨10.1016/j.combustflame.2024.113588⟩. ⟨hal-04654828⟩
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