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Monolayer penta-BCN: A promising candidate for harmful gases detection

Sensors and Actuators A: Physical(2022)

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摘要
•Penta-BCN shows moderate affinity for CO, H2S, NH3 and NO.•It has a significant regulatory effect on H2S, NH3 and NO for work function.•Band gap can be tuned by gases adsorption in penta-BCN monolayer.•The recovery time can be adjusted by adding an external electric field.
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关键词
Monolayer penta-BCN,First-principles calculation,Gas sensor,Work function,Electric field
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