Selective Hydrogenation of Acetylene Catalysed by a B<sub>12</sub>N<sub>12</sub> Cluster Doped with a Single Nickel Atom: A DFT Study
To obtain a catalyst based on a non-precious metal that can replace traditional palladium-based selective catalysts of acetylene hydrogenation, the catalytic performances of two different configurations of a B<sub>12</sub>N<sub>12</sub> cluster doped with a single nickel atom...
Main Authors: | Yun Wang, Lihua Kang |
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Format: | Article |
Language: | English |
Published: |
MDPI AG
2020-01-01
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Series: | Catalysts |
Subjects: | |
Online Access: | https://www.mdpi.com/2073-4344/10/1/115 |
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