RSC Adv.
 2024
DOI: 10.1039/d4ra01519c
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Highly sensitive sensing of CO and HF gases by monolayer CuCl

Shamiala Pervaiz,
M. Usman Saeed,
Sehrish Khan
et al.

Abstract: Using a first-principles approach, the adsorption characteristics of CO and HF on a CuCl monolayer are studied with Grimme-scheme DFT-D2 for accurate description of the long-range (van der Waals) interactions.

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