Citation: Jia-Hao Wang, Bo Cai, Bowen Sun, Zhi-Ling Hou, Shu-Hao Yang, Qinglin Yang, Pei-Yan Zhao, Wen-Ping Li, Yu Zhang, Guang-Sheng Wang. Molecular dipole engineering for tailored dielectric properties in MXene/ZnO heterostructures[J]. Acta Physico-Chimica Sinica, ;2026, 42(6): 100271. doi: 10.1016/j.actphy.2026.100271 shu

Molecular dipole engineering for tailored dielectric properties in MXene/ZnO heterostructures

Jia-Hao Wang ^{1, 2} ,
Bo Cai ^{1, 2} ,
Bowen Sun ^1,, ,
Zhi-Ling Hou ³ ,
Shu-Hao Yang ^{1, 2} ,
Qinglin Yang ¹ ,
Pei-Yan Zhao ² ,
Wen-Ping Li ^4,, ,
Yu Zhang ^{2, 5} ,
Guang-Sheng Wang ^{1, 2,,}

1.
Hangzhou International Innovation Institute, Beihang University, Hangzhou 311115, Zhejiang Province, China
2.
School of Chemistry, Beihang University, Beijing 100191, China
3.
School of Physics and Optoelectronic Engineering, Beijing University of Technology, Beijing 100124, China
4.
School of Physics, Beihang University, Beijing 100191, China
5.
School of Chemistry and Chemical Engineering, Northwestern Polytechnical University, Xi'an 710072, Shaanxi Province, China

Corresponding author: Bowen Sun, sunbw@buaa.edu.cn Wen-Ping Li, liwp@buaa.edu.cn Guang-Sheng Wang, wanggsh@buaa.edu.cn
Received Date: 16 January 2026
Revised Date: 26 February 2026
Accepted Date: 27 February 2026

The optimization of dielectric properties through controlling polarization effects in heterogeneous materials remains challenging due to structural complexity. This work demonstrates the precise regulation of interface polarization strength through molecular grafting-induced dipole reorientation. Experimental analyses confirm that the orientation of these dipoles effectively modulates the interfacial polarization: the –CF₃ group enhances, while the –NH₂ group suppresses electron transfer and polarization loss effects. The optimized MXene/ZnO modified with –CF₃ composite exhibits exceptional electromagnetic wave absorption performance, achieving a minimum reflection loss of −66.7 dB and an effective absorption bandwidth of 5.05 GHz. This work demonstrates a novel strategy for the precise tuning of electromagnetic parameters through interfacial dipole engineering, offering new insights for the design of advanced electromagnetic wave-absorbing materials.
- Dielectric parameters,
- Dipole moment,
- Interface polarization,
- Silane coupling agents,
- ZnO quantum dots
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沈阳化工大学材料科学与工程学院沈阳 110142