Cyclotrimerization of Acetylene on Clusters Con+/Fen+/Nin+(n = 1

Cyclotrimerization of Acetylene on Clusters Con+/Fen+/Nin+(n = 1–16)

Published:2021-11-30 Issue:48 Volume:125 Page:10392-10400
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Gan Wen¹²,Geng Lijun¹,Yin Baoqi¹²,Zhang Hanyu¹²^ORCID,Luo Zhixun¹²^ORCID,Hansen Klavs³

Affiliation:

1. Beijing National Laboratory for Molecular Science, State Key Laboratory for Structural Chemistry of Unstable and Stable Species, Institute of Chemistry, Chinese Academy of Sciences, Beijing 100190, China

2. University of Chinese Academy of Sciences, Beijing 100049, China

3. Center for Joint Quantum Studies and Department of Physics, School of Science, Tianjin University, 92 Weijin Road, Tianjin 300072, China

Funder

National Natural Science Foundation of China

Frontier Cross Project of the National Laboratory for Molecular Sciences

CAS Key Research Project of Frontier Science

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.1c09015

Reference96 articles.

1. 570. The formation of aromatic hydrocarbons at high temperatures. Part VIII. The pyrolysis of acetylene

2. Barriers to thermally allowed reactions and the elusiveness of neutral homoaromaticity

3. The origin of the barriers to thermally allowed, six-electron, pericyclic reactions: the effect of homo-homo interactions on the trimerization of acetylene

4. Acetylene, ethylene, and arene chemistry of palladium surfaces

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