姓名：牛春要 职称：副教授，硕士生导师

最终学历：博士

通讯地址：物理学院A楼414

邮箱：niuchunyao@zzu.edu.cn

一、个人经历：

2014.07-至今 郑州大学物理学院任职

2016.09-2017.10 美国威廉玛丽学院访问学者。

2009.09-2014.07 中科院物理所硕博连读，博士。

2005.09-2009.07 郑州大学物理系，本科。

二、研究方向：

主要从事计算凝聚态物理方面的研究，通过第一性原理计算方法研究材料的物性，探索微观系统的物理规律，预测材料的结构和物理性质及其相互关系。包括半导体表面界面物性研究，新结构新性能材料的预测，低维材料磁性诱导及物性调控，高性能光电催化剂的理论计算及设计等。

三、代表性成果：

主持国家自然科学基金青年基金项目一项，河南省重点研发与推广专项（科技攻关）一项，郑州大学优秀青年教师发展基金一项，郑州大学学科推进计划项目一项，国家博士后一等资助一项，作为主要参与人参与完成国家自然科学基金四项。迄今在PRL、PRX、PRB、Angew. Chem.Int.Ed、Appl.Catal.B、APL、PCCP等杂志发表SCI论文60余篇，其中第一作者或通讯作者30余篇。

四、代表性论文：

1.Wenzhuo Wu#,Chunyao Niu#, Pengfei Yan, Feng Shi, Chunyan Ma, Xinan Yang, Yu Jia, Jun Chen, Muhammad Ibrar Ahmed, Chuan Zhao, Qun Xu;Building of sub-monolayer MoS2-x structure to circumvent the scaling relations in N2-to-NH3 electrocatalysis, Applied Catalysis B: Environmental 298 (2021) 120615.

2.Cheng-Long Shen, Qing Lou,* Chao-Fan Lv, Guang-Song Zheng, Jin-Hao Zang, Tian-Ci Jiang,Zhe Cheng, Kai-Kai Liu,Chun-Yao Niu,*Lin Dong, and Chong-Xin Shan,* Trigonal Nitrogen Activates High-Brightness Chemiluminescent Carbon Nanodots, ACS Materials Lett. 2021, 3,826-837

3.Xiaoyu Huang,Chun-Yao Niu*, Jinping Zhang, Aihua Wang, Yuling Song, and Yu Jia*;A promising auxetic material of CaAs3 monolayer with anisotropic electro-mechanical and optical properties, Appl. Phys. Lett. 119, 063103 (2021);

4.Chunxiang Zhao, Xiaolin Cai, Liangliang Liu, Chengyan Liu, Zaiping Zeng,Chunyao Niu*,Congxin Xia, Yu Jia,Structural, Topological, and Superconducting Properties of Two‐Dimensional Tellurium Allotropes from Ab Initio Predictions;Advanced Theory and Simulations,4 (2021) 2000265

5.Wenzhuo Wu#,Chunyao Niu#，Qingyong Tian, Wei Liu, Guowei Niu, Xiaoli Zheng, Chong Li, Yu Jia*, Cong Wei and Qun Xu*, Amorphous-MoO3x/MoS2 heterostructure: in situ oxidizing amorphization of S-vacancy MoS₂for enhanced alkaline hydrogen evolution; Chem. Commun., 56 (2020) 14701

6.Yifan Xu, Teng Fern Tay, Lingling Cui, Jiajie Fan,Chunyao Niu* ,Dehong Chen, Zheng Xiao Guo,Chenghua Sun, Xiao Li Zhang,* and Rachel A. Caruso,Trace-Level Fluorination of Mesoporous TiO2 ImprovesPhotocatalytic and Pb(II) Adsorbent Performances;Inorg. Chem. 59 ( 2020)17631−17637

7.Hongyan Wang, Zhe Fang, Yu Zhao, Shichang Yao, Jingan Li, Jianfeng Wang, Shijie Zhu,Chunyao Niu*, Yu Jia, Shaokang Guan*; Effects of alloy elements on adsorption of fibrinogen on biodegradable magnesium alloys surfaces: The MD imulations and experimental studies; Applied Surface Science 512 (2020) 145725

8.Kiel T. Williams, Yuan Yao, Jia Li, Li Chen, Hao Shi, Mario Motta,Chunyao Niu,et al; Direct comparison of many-body methods for realistic electronic Hamiltonians;Phys. Rev. X, 10(2020)011041

9.Shouyan Bai,Chun-Yao Niu*, Chong Li, Chunxiang Zhao, and Yu Jia; Ferromagnetic, antiferromagnetic, and Peierls distortion states in IVA-VA nanoribbons; Appl. Phys. Lett. 115, 162401 (2019)

10.Xiaoyu Huang,Chun-Yao Niu*, Jinping Zhang, Aihua Wang, Yu Jia, and Yuling Song;Strain-tunable electronic structure, optical response, and high electron mobility of Bi2O2Se crystals; APL Mater. (2019) 7, 081110

11.Wenzhuo Wu#,Chunyao Niu#, Cong Wei, Yu Jia*, Chong Li, and Qun Xu*；Activation of MoS2 Basal Planes for Hydrogen Evolution through Zinc; Angew. Chem. 2019 (131): 2051 -2055

12.Xiao-Yan Ren#,Chun-Yao Niu#, Seho Yi, Shunfang Li, and Jun-Hyung Cho, Hydrogen adsorption induced nanomagnetism at the Si(111)-(7×7) surface. Phys. Rev. B 2018 (98):195424.

13.Shouyan Bai,Chun-Yao Niu*, Weiyang Yu, Zhili Zhu, Xiaolin Cai and Yu Jia*, Strain Tunable Bandgap and High Carrier Mobility in SiAs and SiAs2 Monolayers from First-Principles Studies. Nanoscale Research Letters 2018 (13): 404.

14.Dahu Chang,Chun-Yao Niu*, Xiaowei Huang, Qiang Sun, Jun-Hyung Cho, and Yu Jia*, Abnormal volumetric thermal expansion in the hourglass fermion materials KHgAs and KHgSb; Phys. Rev. B, 2017(95):104101

15.Zhili Zhu, Xiaolin Cai, Seho Yi, Jinglei Chen, Yawei Dai, Chunyao Niu, Zhengxiao Guo, Maohai Xie, Feng Liu, Jun-Hyung Cho, Yu Jia,* and Zhenyu Zhang*. Multivalency-Driven Formation of Te-Based Monolayer Materials: A Combined First-Principles and Experimental study. Phys. Rev. Lett. 2017 (119): 106101.

16. Xiaolin Cai, Chun-Yao Niu*,Yuan-Yao He, Jianjun Wang, Zhili Zhu, Liwei Zhang and Yu Jia, Quantum Effect Enhanced Magnetism in the C-doped phosphorene Nanoribbons: First-principles Calculations. Physical Chemistry Chemical physics, 2017 (19):28354-28359.

17.Chun-Xiang Zhao,Chun-Yao Niu*, Zhi-Jie Qin, Xiao Yan Ren, Jian-Tao Wang, Jun-Hyung Cho & Yu Jia; H18 Carbon: A New Metallic Phasewith sp2-sp3 Hybridized Bonding Network. Scientific Reports 2016 (6): 21879.

18.Weiyang Yu, Zhili Zhu, Shengli Zhang, Xiaolin Cai, Xiangfu Wang,Chun-Yao Niu*, and Wei-Bing Zhang*,Tunable electronic properties of GeSe/phosphorene heterostructure from first-principles study. Appl. Phys. Lett. 2016 (109): 103104.

19.Xiao-Yan Ren,Chun-Yao Niu*,Wei-Guang Chen, Ming-Sheng Tang and Jun-Hyung Cho,Energetics and kinetics of Cu atoms and clusters on the Si(111)-7x7 surface: first-principles calculations. Phys.Chem.Chem.Phys. 2016 (18): 18549.

20.Jia-Qi Wang, Chun-Xiang Zhao,Chun-Yao Niu*, Qiang Sun and Yu Jia; C20-T carbon: a novel superhard sp³carbon allotrope with large cavities. J. Phys.: Condens. Matter 2016 (28): 475402.