DFT study of CN oxidation (CN+1/2O(2) -> OCN) on the surfaces of chromium-doped nanotubes (Cr-CNT (8, 0) and Cr-BNNT (8,0))
The Cr-carbon nanotubes and Cr-boron nitride nanotubesas novel catalysts were used to find out the details of mechanisms of CN oxidation. The oxidation of CN molecule can process via Cr-CNT and Cr-BNNT catalysts through the Langmuir-Hinshelwood (LH) and Eley-Rideal (ER) mechanisms. The CN molecule j...
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| Main Authors: | , , |
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| Format: | Article |
| Published: |
Springer Verlag
2020
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| Subjects: | |
| Online Access: | http://eprints.um.edu.my/36833/ |
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