基本简介
职称：副教授
学位：博士
毕业学校：墨尔本大学
主要兼职：无
电子邮件：zhouych29@mail.sysu.edu.cn
学历
本科：兰州大学 物理科学与技术学院 物理学
硕士：兰州大学 化学化工学院（功能有机分子国家重点实验室） 有机化学/中科院大连化物所（分子反应动力学国家重点实验室） 物理化学
博士：墨尔本大学 理论与计算化学
学术经历
南方科技大学 物理系 研究助理教授
西班牙 巴塞罗那科学技术研究院，加泰罗尼亚化学研究所 博士后，项目研究员
学科方向
所在学科：物理化学
研究方向：第一性原理计算，机器学习，多尺度器件模拟
研究兴趣：钙钛矿太阳能电池、有机太阳能电池、金属氧化物中的电催化
主持项目
2022年- 2024年 基于机器学习的有机太阳能电池的多尺度模拟计算研究 22103097国家自然科学基金委 30万元
2018年-2020年 钙钛矿材料中离子迁移与极化的多尺度模拟 JCYJ20170817105201098 深圳市科创委 30万
2021年-2024年 化学势依赖的钙钛矿材料表面缺陷与钝化的理论计算模型开发 广州市科技局 5万 + 10 万
荣誉获奖
2018年入选深圳市海外高层人才计划-孔雀计划
2019年入选中山大学百人计划
代表性文章 （+共同一作，*通讯作者）
[1] G. Chen, Y. Zhang, S. Li, J. Zheng, H. Yang, J. Ren, C. Zhu, Y. Zhou*, Y. Chen, J. Fu*, Flexible Artificial Tactility with Excellent Robustness and Temperature Tolerance Based on Organohydrogel Sensor Array for Robot Motion Detection and Object Shape Recognition, Adv. Mater. 2024. (2408193). 1–11.
[2] Z. Liang, X. Li, Q. Chen, X. Wang, P. Su, J. Huang, Y. Zhou*, L. Xiao, J. Liu*, A Direct Z-Scheme Single-Atom MOC/COF Piezo-Photocatalytic System for Overall Water Splitting, ACS Catal. 2024. (14). 10447–10461.
[3] X. Ye, N. Cui, W. Ou, D. Liu, Y. Bao, B. Ai*, Y. Zhou*, Explainable optimized 3D-MoRSE descriptors for the power conversion efficiency prediction of molecular passivated perovskite solar cells through machine learning, J. Mater. Chem. A. 2024. (12). 26224–26233.
[4] H. Wang, Y. Yu, H. Lu, T. Wang, Y. Haruta, X. Wei, G. Xing, M.I. Saidaminov, Y. Zhou*, G. Long*, Three-dimensional lead iodide perovskites based on complex ions, Mater. Adv. 2024. (5). 123–130.
[5] M. Li, Z. Yue, Z. Ye, H. Li, H. Luo, Q. Yang*, Y. Zhou*, Y. Huo*, Y. Cheng*, Improving the Efficiency and Stability of MAPbI 3 Perovskite Solar Cells by Dipeptide Molecules, Small. 2024. (20). 2311400.
[6] X. Ye, W. Ou, B. Ai*, Y. Zhou*, Molecular modification of MAPbI 3 surface: insights from first-principles theory studies, Phys. Chem. Chem. Phys. 2023. (25). 32250–32260.
[7] W. Ou, X. Ye, Y. Zhou*, Recent advances in Ni (oxy) hydroxides and Ni sulfides catalysts for oxygen evolution reactions, Coord. Chem. Rev. 2023. (493). 215274.
[8] J. Ma, Z. Du, Z. Lei, L. Wang, Y. Yu, X. Ye, W. Ou, X. Wei, B. Ai, Y. Zhou*, Intermolecular 3D-MoRSE Descriptors for Fast and Accurate Prediction of Electronic Couplings in Organic Semiconductors, J. Chem. Inf. Model. 2023. (63). 5089–5096.
[9] Y. Lin, Y. Zhou+, S. Huang, M. Xiao, D. Han, J. Qin, S. Wang, Y. Meng, Catalytic Disproportionation for Suppressing Polysulfide Shuttle in Li–S Pouch Cells: Beyond Adsorption Interactions, Adv. Energy Mater. 2022. (12). 2201912.
[10] X. Wang, Y. Cao, Y. Peng, L. Wang, W. Hou, Y. Zhou*, Y. Shi, H. Huang, Y. Chen, Y. Li*, Concurrent and Mechanochemical Activation of Two Distinct and Latent Fluorophores via Retro-Diels–Alder Reaction of an Anthracene–Aminomaleimide Adduct, ACS Macro Lett. 2022. (11). 310–316.
[11] Y. Sun, L. Wang, O. Guselnikova, O. Semyonov, J. Fraser, Y. Zhou*, N. López, A.Y. Ganin*, Revealing the activity of Co 3 Mo 3 N and Co 3 Mo 3 N 0.5 as electrocatalysts for the hydrogen evolution reaction, J. Mater. Chem. A. 2022. (10). 855–861.
[12] Y. Zhou*, G. Long, Low density of conduction and valence band states contribute to the high open-circuit voltage in perovskite solar cells, J. Phys. Chem. C. 2017. (121). 1455–1462.
[13] J. Wang+, J. Li+, Y. Zhou+, C. Yu, Y. Hua, Y. Yu, R. Li, X. Lin, R. Chen, H. Wu, H. Xia*, H.L. Wang*, Tuning an Electrode Work Function Using Organometallic Complexes in Inverted Perovskite Solar Cells, J. Am. Chem. Soc. 2021. (143). 7759–7768.
[14] Y.-N. Lu, J.-X. Zhong, Y. Yu, X. Chen, C.-Y. Yao, C. Zhang, M. Yang, W. Feng, Y. Jiang, Y. Tan, others, L. Gong, X. Wei, Y. Zhou*, L. Wang*, W.-Q. Wu*, Constructing an n/n + homojunction in a monolithic perovskite film for boosting charge collection in inverted perovskite photovoltaics, Energy Environ. Sci. 2021. (14). 4048–4058.
[15] Y. Zhou*, N. Lopez*, The role of Fe species on NiOOH in oxygen evolution reactions, ACS Catal. 2020. (10). 6254–6261.
[16] G. Long+*, Y. Zhou+, M. Zhang+, R. Sabatini, A. Rasmita, L. Huang, G. Lakhwani, W. Gao*, Theoretical prediction of chiral 3D hybrid organic--inorganic perovskites, Adv. Mater. 2019. (31). 1807628.
[17] W. Chen+, Y. Zhou+, L. Wang, Y. Wu, B. Tu, B. Yu, F. Liu, H.-W. Tam, G. Wang, A.B. Djurišić, L. Huang*, Z. He*, others, Molecule-Doped Nickel Oxide: Verified Charge Transfer and Planar Inverted Mixed Cation Perovskite Solar Cell, Adv. Mater. 2018. (30). 1800515.
[18] W. Chen+, Y. Zhou+, G. Chen, Y. Wu, B. Tu, F.-Z.F.F.-Z. Liu, L. Huang, A.M.C. Ng, A.B. Djurišić, Z. He*, Alkali chlorides for the suppression of the interfacial recombination in inverted planar perovskite solar cells, Adv. Energy Mater. 2019. (9). 1803872.
[19] Y. Zhou*, G. Long, A. Li, A. Gray-Weale, Y. Chen, T. Yan, Towards predicting the power conversion efficiencies of organic solar cells from donor and acceptor molecule structures, J. Mater. Chem. C. 2018. (6). 3276–3287.
[20] Y. Zhou+, W. Li+, M. Wu, L.-D. Zhao, J. He, S.-H. Wei, L. Huang*, Influence of defects on the thermoelectricity in SnSe: A comprehensive theoretical study, Phys. Rev. B. 2018. (97). 245202.
