学术论文: |
长期围绕半导体功能材料,以基于电子结构计算的材料模拟为手段,开展性质优化及新材料设计研究,取得了一系列创新性成果,发表SCI论文25篇,其中以第一作者/共同一作/通讯作者在J. Am. Chem. Soc.、Nano Lett.、Nano Energy等期刊发表论文13篇(标注#为共同一作,*为通讯作者): 1. Jingkai Quan, Shidong Yu, Bangyu Xing, Xin He*, and Lijun Zhang*, Two-dimensional Ruddlesden-Popper halide perovskite solar absorbers with short-chain interlayer spacers, Phys. Rev. Materials 6, 065405 (2022). 2. Weiqiang Feng#, Ruoting Zhao#, Xiaoyu Wang, Bangyu Xing, Yilin Zhang, Xin He* and Lijun Zhang*, Global instability index as a crystallographic stability descriptor of halide and chalcogenide perovskites, J. Energy Chem. 70, 1-8 (2022). 3. Guoqi Zhao#, Jiahao Xie#, Kun Zhou, Bangyu Xing, Xinjiang Wang, Fuyu Tian, Xin He* and Lijun Zhang, High-throughput computational material screening of the cycloalkane-based two-dimensional Dion–Jacobson halide perovskites for optoelectronics, Chinese Phys. B 31, 037104 (2022). 4. Fuyu Tian#, Weiqiang Feng#, Bangyu Xing, Xin He*, Wissam A. Saidi* and Lijun Zhang, Grain boundaries in methylammonium lead halide perovskites facilitate water diffusion, Advanced Energy and Sustainability Research 2, 2100087 (2021). 5. Xueting Wang, Xingang Zhao, Xinjiang Wang, Hongdong Li*, Xin He*, and Lijun Zhang, Discovery of new phases of bismuth oxyselenide semiconductor Bi2OSe2 by global structure search approach, Adv. Theor. Simul. 4, 2000316 (2021). 6. Xiaoyu Wang#, Xue Wang#, Hongshuai Zou, Yuhao Fu, Xin He* and Lijun Zhang*, Temperature-induced phase transition of two-dimensional semiconductor GaTe, Chinese Phys. B 30, 016402 (2021). 7. Yawen Li, Guangren Na, Shulin Luo, Xin He*, Lijun Zhang*, Structural, thermodynamical and electronic properties of all-inorganic lead halide perovskites, Acta Phys.-Chim. Sin 37, 2007015 (2021). 8. Wanpei Hu#, Xin He#, Zhimin Fang, Weitao Lian, Yanbo Shang, Xingcheng Li, Weiran Zhou, Mengmeng Zhang, Tao Chen,Yalin Lu, LijunZhang*, LimingDing*, ShangfengYang*, Nano Energy 68, 104362 (2020). 9. Yangsen Xu#, Xin He#, David J. Singh, Lijun Zhang*, and Ruihu Wang*, Solid salt confinement effect: an effective strategy to fabricate high crystalline polymer carbon nitride for enhanced photocatalytic hydrogen evolution, Appl. Catal. B: Environ. 246, 349-355 (2019). 10. Xin He, David J. Singh*, Patsorn Boon-on, Ming-Way Lee*, and Lijun Zhang*, J. Am. Chem. Soc. 140, 18058-18065 (2018). 11. Junwen Zeng#, Xin He#, Shi-Jun Liang*, Erfu Liu, Yuanhui Sun, Chen Pan, Yu Wang, Tianjun Cao, Xiaowei Liu, Chengyu Wang, Lili Zhang, Shengnan Yan, Guangxu Su, Zhenlin Wang, Kenji Watanabe, Takashi Taniguchi, David J. Singh, Lijun Zhang*, and Feng Miao*, Nano Lett. 18, 7538-7545 (2018). 12. Xin He, Yuhao Fu, David J. Singh*, Lijun Zhang*, Stability, electronic structures and thermoelectric properties of binary Zn–Sb materials, J. Mater. Chem. C 4, 11305 (2016). 13. Xin He, Meijiao Sun, Suo Li, Shuqin Gao, Chenglin Sun, Zuowei Li, Zhi He, Wenzhi Song*, Spectrosc. Spect. Anal. 36, 3455 (2016). |