Yi-Ming Jia
Northwest Normal University
2 Papers
10 Citations
Yi-Ming Jia is an academic researcher from Northwest Normal University. The author has contributed to research in topics: Atoms in molecules & Natural bond orbital. The author has an hindex of 1, co-authored 2 publications.
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Papers
Theoretical study of Ni+ assisted C-C and C-H bond activations of propionaldehyde in the gas phase.
TL;DR: In this article, the reactions of Ni+ with propionaldehyde in the gas phase have been systematically investigated using density functional theory at the B3LYP/def2-TZVP level.
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Theoretical investigation on the gas phase decomposition of ethyl acetate by Ni
TL;DR: In this article, density functional theory calculations were performed to systematically investigate the reaction of Ni+ with ethyl acetate in the gas phase, and all possible reaction pathways were identified, which led to the formation of ketene or ethanol, two acetal units, and acetic acid or ethylene.
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