Comparative Study of Phosgene Gas Sensing Using Carbon and Boron Nitride Nanomaterials—A DFT Approach

Comparative Study of Phosgene Gas Sensing Using Carbon and Boron Nitride Nanomaterials—A DFT Approach

Phosgene (COCl<sub>2</sub>), a valuable industrial compound, maybe a public safety and health risk due to potential abuse and possible accidental spillage. Conventional techniques suffer from issues related to procedural complexity and sensitivity. Therefore, there is a need for the deve...

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Bibliographic Details
Main Authors: Emmanuel Obroni Kweitsu, Stephen Kanga Armoo, Kwabena Kan-Dapaah, Eric Kwabena Kyeh Abavare, David Dodoo-Arhin, Abu Yaya
Format: Article
Language:English
Published: MDPI AG 2021-12-01
Series:Molecules
Subjects:
phosgene
boron nitride
carbon nanotube
DFT
LDA
Online Access:https://www.mdpi.com/1420-3049/26/1/120

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https://www.mdpi.com/1420-3049/26/1/120

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