X射线光电子能谱
材料科学
兴奋剂
吸附
结合能
密度泛函理论
催化作用
氢
分子
半导体
纳米技术
光电子学
化学工程
物理化学
原子物理学
计算化学
化学
工程类
有机化学
物理
生物化学
作者
Xiaowu Wang,Zhigang Zeng,Zhiheng Ma,Musen Li,Yin Wang,Zheng Wang,Ruiling Gao,Xin Jia,Pengfei Hu,Bo Lü,Zhenggang Xue,Jiaqiang Xu
标识
DOI:10.1002/adfm.202419570
摘要
Abstract Electron state of catalyst surface is crucial to optimize the adsorption/intermediate state of gas molecules during the sensing reaction. Herein, we develop an electron‐dilution strategy by introducing Pd/Pt species into semiconductor ZnSe to construct electron‐deficient Se surface, exhibiting excellent H 2 sensing performances. It is found that different metal doping can induce remarkable electric environment changes of Se atoms. For example, compared with Pd, Pt display stronger electronic dilution ability to adjacent Se atoms. X‐ray photoelectron spectroscopy (XPS) characterizations further prove that the doping of Pd/Pt will induce the generation of the electron‐deficient Se sites, appearing a new and high binding energy state. Furthermore, the density functional theory (DFT) calculations show that the deficient Se sites on the Pt‐ZnSe surface could reduce the level of anti‐bonding orbital filling, thus enhancing the stability of the Se‐Hads bond and strengthening the H 2 adsorption. As a result, the Pt‐ZnSe based micro‐electromechanical systems (MEMS) gas sensors exhibit high response value of 3.22 to 10 ppm H 2 at low operation temperature of 145 °C. Inserting the Pt‐ZnSe MEMS sensors array into multifunctional wireless sensing device, it can realize real‐time H 2 /temperature/humidity monitoring and cloud data transmission for hydrogen agriculture on production, preserving and storing crop.
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