1. Green synthesized ZnO/NiO heterostructures based quick responsive LPG sensor for the detection of below LEL with DFT calculations
- Author
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Ajeet Singh and Bal Chandra Yadav
- Subjects
Metal oxide ,ZnO/NiO heterostructure ,Green synthesis ,LPG sensor ,DFT calculations ,Industrial electrochemistry ,TP250-261 - Abstract
The current research work reports on the detection of liquefied petroleum gas (LPG) at room temperature. The ZnO/NiO heterostructure was synthesized via green method and characterized by various techniques. The surface morphological and structural analysis has been performed by scanning electron microscope, transmission electron microscope and X-ray diffractometer. The Rietveld refinement analysis confirmed the polycrystalline nature of ZnO/NiO and existing hexagonal (ZnO) and cubic (NiO) crystal structures. The optical properties were analyzed by UV–visible spectroscopy and optical band gap of ZnO, NiO and ZnO/NiO were found to be 3.62 eV, 3.81 eV and 3.71 eV respectively. The DFT analysis was performed by B3LYP/LAN2DZ basis set with the interaction from LPG of ZnO, NiO and ZnO/NiO composite for better understanding of the sensing characteristics of devices. The ZnO, NiO, and ZnO/NiO were investigated for the detection of the LPG from below lower explosion limit (LEL) i.e. 0.5 vol% to 2.5 vol%. Sensor response of ZnO/NiO heterostructure-based sensor was found 7.72 at 2.5 vol% which is 2.6 times higher than pure ZnO and NiO. The fast response and recovery times of ZnO/NiO were found to 7.83 s and 11.01 s, respectively at 0.5 vol% LPG. Also, the ZnO/NiO is highly selective for LPG in comparison to other analytes like ethanol, acetone, ammonia, and CO2 etc. Thus ZnO/NiO heterostructures can be effectively used for the detection of LPG at room temperature against below LEL.
- Published
- 2023
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