Citation: Wei Sun, Yongjing Wang, Kun Xiang, Saishuai Bai, Haitao Wang, Jing Zou, Arramel, Jizhou Jiang. CoP修饰Ti₃C₂T_x MXene纳米复合材料作为高效析氢反应电催化剂[J]. Acta Physico-Chimica Sinica, ;2024, 40(8): 230801. doi: 10.3866/PKU.WHXB202308015 shu

CoP修饰Ti₃C₂T_x MXene纳米复合材料作为高效析氢反应电催化剂

Wei Sun ¹ ,
Yongjing Wang ¹ ,
Kun Xiang ^1,2,, ,
Saishuai Bai ¹ ,
Haitao Wang ¹ ,
Jing Zou ¹ ,
Arramel ³ ,
Jizhou Jiang ^1,,

1.
School of Environmental Ecology and Biological Engineering, School of Chemistry and Environmental Engineering, Key Laboratory of Green Chemical Engineering Process of Ministry of Education, Engineering Research Center of Phosphorus Resources Development and Utilization of Ministry of Education, Novel Catalytic Materials of Hubei Engineering Research Center, Wuhan Institute of Technology, Wuhan 430205, China;
2.
Key Laboratory of Optoelectronic Chemical Materials and Devices of Ministry of Education, Jianghan University, Wuhan 430205, China;
3.
Nano Center Indonesia, Jalan Raya PUSPIPTEK, South Tangerang, Banten 15314, Indonesia

Corresponding author: Kun Xiang, Jizhou Jiang,
Received Date: 12 August 2023
Revised Date: 18 September 2023
Accepted Date: 21 September 2023

Fund Project: The project was supported by the National Natural Science Foundation of China (62004143, 22174033), the Key R&D Program of Hubei Province (2022BAA084), the Opening Project of Key Laboratory of Optoelectronic Chemical Materials and Devices of Ministry of Education, Jianghan University (JDGD-202227), and the Knowledge Innovation Program of Wuhan Shuguang Project (2022010801020355).

高效、经济和环保是电化学水分解制氢电催化剂的关键要素。二维(2D) MXene材料因其独特的物理化学性质而受到广泛关注。虽然有许多不同种类的MXene材料，但只有少数具有本征析氢反应(HER)催化活性。然而，MXene材料具有很多优点，如较大的比表面积、高电导率和丰富的表面官能团，因此可以作为与其他物质复合的理想平台。本研究首先通过密度泛函理论(DFT)预测了CoP与Ti₃C₂T_x MXene (其中T_x =―F和―OH官能团)具有低的氢吸附自由能(ΔG_H*)。接着，我们合成了CoP-Ti₃C₂T_x MXene纳米复合材料，并在0.5 mol∙L⁻¹ H₂SO₄中测试了其电催化HER性能。该材料在电流密度为10 mA∙cm⁻²时表现出了低的过电位(135 mV)和Tafel斜率为48 mV∙dec⁻¹。理论计算表明，CoP-Ti₃C₂T_x MXene纳米复合材料的优异电催化性能源于Ti₃C₂T_x的高金属导电性、良好的界面电荷转移、快速的氢吸附/解吸过程以及优化的电子结构。
- Ti₃C₂T_x MXene,
- Hydrogen evolution reaction,
- CoP,
- Density functional theory,
- Interface charge transfer
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CoP修饰Ti3C2Tx MXene纳米复合材料作为高效析氢反应电催化剂

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CoP修饰Ti₃C₂T_x MXene纳米复合材料作为高效析氢反应电催化剂