邹代峰，博士，副教授，已发表SCI论文50余篇。中国科学院深圳先进技术研究院客座研究员、深圳市高层次专业人才后备级人才、湖南省量子科技学会理事、湖南科技大学优秀教师。在Applied Physics Letters、 Journal of Materials Chemistry A等期刊上已发表SCI索引论文50余篇。

研究方向

智能材料多场耦合计算模拟

联系方式

Email: zoudaifeng@hnust.edu.cn

发表的SCI论文：

[1] Xueyan Bai, Daifeng Zou^*, Chihou Lei, Zhijian He, Yunya Liu^*, Polarization-controlled contact barriers enable giant tunneling electroresistance in van der Waals ferroelectric tunnel junctions. Applied Physics Letters, 126, 162902 (2025). [Editor’s Pick]

[2] Shiying He, Chihou Lei, Daifeng Zou^*, Polarization-driven reversible magnetic anisotropy switching and half-metal to semiconductor transition in intrinsic multiferroic ScCrCO₂ monolayer. Applied Physics Letters, 127, 012902 (2025).

[3] Zhijian He, Guoan Ding, Daifeng Zou^*, Chihou Lei^*, Shuhong Xie, Yunya Liu^*, A nonvolatile multistate memory by electric-field control of half-metallicity in a noncentrosymmetric FeI₂ bilayer coupled with ferroelectric α-In₂Se₃. Applied Physics Letters, 127, 132903 (2025).

[4] Zhijian He, Daifeng Zou^*, Polarization-controlled switching of magnetic anisotropy in CrSe₂/Sc₂CO₂ multiferroic heterostructures. Journal of Physics: Condensed Matter, 37, 265803 (2025).

[5] Shiying He, Huimin Qu, Daifeng Zou^*, Electronic structure, magnetic anisotropy and Curie temperature of multiferroic MnSe₂/Sc₂CO₂ van der Waals heterostructures. Physics Letters A, 548, 130555 (2025).

[6] Shiying He, Daifeng Zou^*, Shuhong Xie^*, Polarization-controlled perpendicular magnetic anisotropy and reversible metal-insulator transition in intrinsic multiferroic AlCrS₃ monolayer, Physica B: Condensed Matter, 716, 417730 (2025).

[7] Shiying He, Daifeng Zou^*, Yuqing Zhao*, Polarization-mediated electronic characteristics in Sc₂CO₂-based 2D metal-ferroelectric heterostructures. Journal of Physics: Condensed Matter, 37, 135504 (2025).

[8] Shiying He, Daifeng Zou^*, Shuhong Xie^*, MnInP₂S₆ monolayer: A promising half-metallic multiferroic material with perpendicular magnetic anisotropy and high Curie temperature, Physica B: Condensed Matter, 715, 417605 (2025).

[9] Liyan Li, Jiayi Yu, Daifeng Zou^*, Polarization-controlled band engineering in TaS₂/Sc₂CO₂ heterostructures for giant tunneling electroresistance， Physics Letters A, 560, 130972 (2025).

[10] Shiying He, Daifeng Zou^*, Shuhong Xie^*, Robust perpendicular magnetic anisotropy and high curie temperature in a Janus MnSSe monolayer， Physics Letters A, 560, 130975 (2025).

[11] Liyan Li, Daifeng Zou^*, Weiyao Jia*, Shuhong Xie*, Polarization-mediated electromagnetic and transport properties of multiferroic MnSe₂/Al₂S₃ van der Waals heterostructures, Current Applied Physics, 80, 234 (2025).

[12] Guoan Ding, Zhijian He, Changxing Zhao, Shuhong Xie^*, Daifeng Zou^*, Interlayer sliding-engineered multiferroicity in 2D FeCl₂: Coexistence of ferroelectric half-metallicity and out-of-plane ferromagnetism， Physics Letters A, 560, 130948 (2025).

[13] Shiying He, Daifeng Zou^*, Chihou Lei, Zhijian He, Yunya Liu^*, Enhancement of tunneling electroresistance in metal/two-dimensional ferroelectric tunnel junctions: Route for polarization-modulated interface transport. Journal of Physics: Condensed Matter, 36, 505502 (2024).

[14] Shiying He, Daifeng Zou^*, Yuqing Zhao*, Enhanced tunneling electroresistance through polarization-controlled band alignments in α-In₂Se₃-based ferroelectric tunnel junctions, Current Applied Physics, 59, 122 (2024).

[15] Shiying He, Daifeng Zou^*, Enhanced tunneling electroresistance through interfacial charge-modulated barrier in α-In₂Se₃-based ferroelectric tunnel junction. Journal of Physics: Condensed Matter, 16, 105301 (2024).

[16] Zhijian He, Jinlin Peng, Chihou Lei, Shuhong Xie^*, Daifeng Zou^*, Yunya Liu^*, Prediction of superior thermoelectric performance in unexplored doped-BiCuSeO via machine learning, Materials & Design, 229, 111868 (2023). [26次]

[17] Zhijun Wang, Zhijian He, Chihou Lei, Daifeng Zou^*, Yunya Liu*, Phase transition enhanced thermoelectric performance for perovskites: The case of AgTaO₃, Current Applied Physics, 48, 84 (2023).

[18] Chunpeng Zou, Chihou Lei, Daifeng Zou^*, Yunya Liu*, Uniaxial tensile strain induced the enhancement of thermoelectric properties in n-type BiCuOCh (Ch=Se, S): a first principles study, Materials, 13, 1755 (2020).

[19] Daifeng Zou^*, Chuanbin Yu, Yuhao Li, Yun Ou, and Yongyi Gao, Pressure-induced enhancement in the thermoelectric properties of monolayer and bilayer SnSe₂, Royal Society Open Science 5, 171827 (2018).

[20] Rui Tan, Chunpeng Zou, Kai Pan, Daifeng Zou^*, Yunya Liu^* Enhancing thermoelectric properties of BiCuSeO via uniaxial compressive strain: First-principles calculations. Journal of Alloys and Compounds 743, 610 (2018). [22次]

[21] Daifeng Zou*, Chuanbin Yu, Yuhao Li, and Yun Ou, Predicted high thermoelectric performance of quasi-two-dimensional compound GeAs using first-principles calculations, Chinese Physics Letters, 11, 117202 (2017).

[22] Wanhuizi Shen, Daifeng Zou*, Guozhen Nie, and Ying Xu, Biaxial strain-induced enhancement in the thermoelectric performance of monolayer WSe₂, Chinese Physics B, 11, 117202 (2017).

[23] Daifeng Zou, Hairong Zheng*, and Jiangyu Li*, Comparative studies of the electronic structure and thermoelectric properties in orthorhombic and tetragonal BaCu₂Se₂ by first-principles calculations, RSC Advances, 6, 60717 (2016).

[24] Daifeng Zou, Hairong Zheng*, and Jiangyu Li*, Predicted thermoelectric properties of natural superlattice structural compounds BaCuChF (Ch = S, Se and Te) by first-principles calculations, Journal of Alloys and Compounds, 686, 571 (2016). [13次]

[25] Daifeng Zou, G. Z. Nie, Y. Li, Y. Xu, Hairong Zheng*, and Jiangyu Li*, Band engineering via biaxial strain for enhanced thermoelectric performance in stannite-type Cu₂ZnSnSe₄, RSC Advances, 5, 24908 (2015). [16次]

[26] Daifeng Zou, Yunya Liu, Shuhong Xie, Jianguo Lin, Hairong Zheng*, and Jiangyu Li*, High pressure effect on electronic structure and thermoelectric properties of BiCuSeO: First-principles calculations, RSC Advances, 4, 54819 (2014). [43次]

[27] Daifeng Zou, Shuhong Xie, Yunya Liu*, Jianguo Lin, and Jiangyu Li*, Electronic structures and thermoelectric properties of layered oxychalcogenides BiCuOCh (Ch=S, Se, and Te): First-principles calculations, Journal of Materials Chemistry A, 1, 8888 (2013). [155次]

[28] Daifeng Zou, Shuhong Xie*, Yunya Liu, Jianguo Lin, and J. Y. Li*, Electronic structure and thermoelectric properties of half-Heusler Zr_0.5Hf_0.5NiSn by first-principles calculations, Journal of Applied Physics, 113, 193705 (2013). [83次]

[29] Daifeng Zou, Shuhong Xie, Yunya Liu*, Jianguo Lin, and Jiangyu Li*, First-principles study of thermoelectric and lattice vibrational properties of chalcopyrite CuGaTe₂, Journal of Alloys and Compounds, 570, 150 (2013). [72次]

[30] Daifeng Zou, Yunya Liu*, Shuhong Xie, Jianguo Lin, and Jiangyu Li*, Effect of strain on thermoelectric properties of SrTiO₃: First-principles calculations, Chemical Physics Letters, 586, 159 (2013). [42次]

[31] Haixuan Liu, Weijie Liao, Dawei Deng, Qing-Xia Ge, Daifeng Zou, Ying Xu, Zhen-Kun Tang, Wenjin Yin*, Unique Pathways of Sliding Ferroelectricity in Few-layered SnP₂Se₆ with Ultrahigh Carrier Mobility: A first-Principles Study. The Journal of Physical Chemistry C, 129, 15905 (2025).

[32] Ao Jie, Yong-Qi Ning, Fang Chen,* Daifeng Zou, Shao-long Jiang, Yuqing Zhao*, Designing Non-volatile Ferroelectric Control of Magnetic Order in Multiferroic In₂Se₃/Bilayer FeCl₂/In₂Se₃ Heterostructure. Journal of Physics: Condensed Matter, 37, 345802 (2025).

[33] Hongshun He; Yunbo Li; Jifeng Luo; Qingxia Ge; Jian Wu; Daifeng Zou; Ying Xu; Wenjin Yin. Tunable transport mode of polaron in polarized Janus MoSSe few-layer structures: a constrained density functional theory study. Dalton Transactions, 54, 4726(2025).

[34] Yufei Lang, Daifeng Zou, Ying Xu, Shaolong Jiang, Yuqing Zhao*, and Y.-S. Ang*, Electronic characteristics of the two-dimensional van der Waals ferroelectric α-In₂Se₃/Cs₃Bi₂I₉ heterostructures. Applied Physics Letters, 124, 5 (2024).

[35] L. Liu, Z. He, B. Wu, H. Song, X. Zhong, J. Wang, Daifeng Zou, and Juanjuan Cheng, Layered CrO₂·nH₂O as a cathode material for aqueous zinc-ion batteries: ab initio study, Physical Chemistry Chemical Physics, 26, 23811 (2024).

[36] Zhijian He, Daifeng Zou, Qiong Yang, T. Duan, Y. Tan, Chihou Lei, Shuhong Xie*, Yunya Liu*, Polarization-induced magnetoelectric effect in Fe₃Ga/HfO₂/Fe₃Ga heterojunction, Applied Physics Express, 16,121001 (2023).

[37] L. Liu, X. Guan, H. Song, Y. Tang, X. Zhong, J. Wang, Daifeng Zou, Juanjuan Cheng, Effects of Si, B doping on PC₃ monolayer as anode for Na-ion batteries, Physica E: Low-dimensional Systems and Nanostructures, 152, 115742 (2023).

[38] Ziwen Zhang, Z.-S. Liu, J.-J. Zhang, B.-N. Sun, Daifeng Zou, Guozhen Nie, M. Chen, Yuqing Zhao, S. Jiang, Interfacial contact barrier and charge carrier transport of MoS₂/metal(001) heterostructures, Physical Chemisity Chemecal Physics, 25, 9548-9558 (2023).

[39] Zhuoni Dai, Ying Xu*, Daifeng Zou, Wenjin Yin, Junnian Wang, InN/XS₂ (X=Zr, Hf) vdW heterostructures: promising Z-Scheme systems with high hydrogen evolution activity for photocatalytic water splitting, Physical Chemisity Chemecal Physics, 25, 8144-8152 (2023).

[40] Y. Liu, B.W. Tang, B. Wen, X.-B. Li, Daifeng Zou, Yifeng Chai, Ying Xu, X.L. Wei, Wenjin Yin, Non-metal atom modified SnS₂ sheet for CO₂ photoreduction with significant activity and selectivity improvements: A first-principles study, Applied Surface Science, 584,152618 (2022).

[41] H. Zhang, D. Deng, Daifeng Zou, X. Li, Z. Tang, X Wei, Qingxia Ge, Wenjin Yin*, The unique photoelectronic properties of the two-dimensional Janus MoSSe/WSSe superlattice: a first-principles study, Dalton Transaction, 51,161102 (2022).

[42] Xueting Zhu, Ying Xu*, Yong Cao, Daifeng Zou, Wei Shen, Direct Z-scheme arsenene/HfS₂ van der Waals heterojunction for overall photocatalytic water splitting: First-principles study, Applied Surface Science, 574,151650 (2022).

[43] Yong Cao, Xueting Zhu, Daifeng Zou, Wei Shen, Ying Xu*, Investigation of two-dimensional HfS₂/PtSSe hetero-junction with strong visible light adsorption and strain tunable bandgap, Journal of Physics D, 55, 457301 (2022).

[44] Wanting Wan, Y. L. Hu, Y. Xu, Daifeng Zou, H. L. Li, C. Tan, Yuqing Zhao*, First-principles study on optoelectronic properties of lead-free inorganic iodide double perovskite Cs₂AgSb_1-xGa_xI₆, Solid State Communications, 356, 114936 (2022).

[45] Yuqing Zhao, Ying Xu, Daifeng Zou, Junnian Wang, G. Xie, Biao Liu, Mengqiu Cai, Shaolong Jiang, First-principles study on photovoltaic properties of 2D Cs₂PbI₄-black phosphorus heterojunctions. Journal of Physics: Condensed Matter, 32(19), 195501 (2020).

[46] Wenjin Yin*, Minwei Liu, X. Fan, Qingxia Ge, B. Wen, Daifeng Zou, Ying Xu, X. Wei, M. Chen, Role of intrinsic dipole on photocatalytic water splitting for janus MoSSe/Nitrides heterostructure: A first-principles study, Progress in Natural Science: Materials International, 29(3), 335 (2019).

[47] Gaokuo Zhong, Daifeng Zou, Shuhong Xie, and Jiangyu Li*, First-principles study of interfacial magnetoelectric coupling in Fe₃Ga/BaTiO₃/Fe₃Ga heterostructure, Journal of Applied Physics, 125, 184102 (2019).

[48] Y. Li, C. Yu, Y. Gan, Y. Kong, P. Jiang, Daifeng Zou, P. Li, X. Yu, R. Wu, H. Zhao, Cunfa Gao, J. Y. Li, Elastic properties and intrinsic strength of two-dimensional InSe flakes, Nanotechnology, 30(33), 335703 (2019).

[49] Yuhao Li, Chuanbin Yu, Y. Gan, P. Jiang, J. Yu, Yun Ou, Daifeng Zou, C. Huang, J. Wang, T. Jia, Q. Luo, X. Yu, H. Zhao, and Cunfa Gao*, Jiangyu Li*, Mapping the elastic properties of two-dimensional MoS₂ via bimodal atomic force microscopy and finite element simulation, npj Computational Materials, 4, 49 (2018). [109次]

[50] Ying Xu*, Y. Zhou, Guozhen Nie, Daifeng Zou, and Z. M. Ao, Tailoring the photocatalytic activity of WO₃ by Nb-F codoping from first-principles calculations, Chinese Journal of Physics, 56, 2285 (2018).

[51] Peng Jiang, Fei Yan, E. N. Ehsan, Shuhong Xie, Daifeng Zou, Xiaoyan Liu, Hairong Zheng, Jiangyu Li*. Electromechanical coupling of murine lung tissues probed by Piezoresponse Force Microscopy. ACS Biomaterials Science & Engineering, 3, 1827-1835 (2017).

[52] C. Xu, H. Jin*, Q Zhang, C Huang, Daifeng Zou, F. He, and S. Hou. A novel Co-ions complexation method to synthesize pyrochlore La₂Zr₂O₇. Journal of the European Ceramic Society, 37, 2871-2876 (2017).

[53] Chuanbin Yu, Daifeng Zou, Yuhao Li, H. B. Yang, Cunfa Gao, An arc-shaped crack in nonlinear fully coupled thermoelectric materials. Acta Mechanica, 229, 1989-2008 (2017). [25次]

[54] Ying Xu*, Guozhen Nie, Daifeng Zou, J. W. Tang, and Z. Ao*. N-Mg dual-acceptor co-doping in CuCrO₂ studied by first-principles calculations. Physics Letters A, 380, 3861-3865 (2016).

[55] Ying Xu*, Z. M. Ao, Daifeng Zou, Guozhen Nie, Wei Sheng, and D. W. Yuan. Strain effects on the electronic structure of ZnSnP₂ via modified Becke–Johnson exchange potential. Physics Letters A, 379, 427-430 (2015).

[56] Y. Wei, L. H. Xu, Y. W. Tao, Xuejun Zheng*, Junhe Yang, Daifeng Zou, and S. X. Mao, Width-to-thickness ratio dependence on photoplastic effect of ZnS nanobelt. Applied Physics Letters, 101, 091904 (2012).