院训

张照胜

个人简介:

男,1989年。

北京师范大学博士(2016-2019)。2019年A类引进河北大学,讲师(校聘教授),硕士生导师。

以第一作者或通讯作者身份发表多篇J. Am. Chem. Soc.、Chem、Nano Lett.、J. Phys. Chem. Lett.等SCI论文。

先后主持河北省自然科学基金青年项目、国家自然科学基金青年项目、河北省教育厅青年拔尖人才项目等。

E-mail:misaraty@163.com

主讲课程、研究方向、已购软件:

主讲课程:《物理化学》、《物理化学实验》、《常用化学软件概述》等。

研究方向:光电转换材料机器学习、激发态动力学及缺陷性质等研究。

已购软件:Vienna Ab initio Simulation Package(VASP)、WIEN2k、MATLAB(包含Parallel Computing Toolbox、 Curve Fitting Toolbox、 Optimization Toolbox、 Global Optimization Toolbox、 Symbolic Math Toolbox、 Partial Differential Equation Toolbox、 Statistics and Machine Learning Toolbox、 Deep Learning Toolbox、 Database Toolbox)。

代表性论文:

1.Zhang, Z.*; Liu, S.; Zhang, Y. Refining Diis Algorithms for Si and GaAs Solar Cells: Incorporation of Weight Regularization, Conjugate Gradient, and Reverse Automatic Differentiation Techniques.Phys. Chem. Chem. Phys.2024,26, 12717-12724.

2.Zhang, Z.*; Zhang, Y.; Liu, S. Integrative Approach of Machine Learning and Symbolic Regression for Stability Prediction of Multicomponent Perovskite Oxides and High-Throughput Screening.Comput. Mater. Sci2024,236, 112889.

3.Zhang, Z.*, Metal Halide Perovskite Nanotubes for High-Performance Solar Cells with Ab Initio Analysis.J. Phys. Chem. Lett.2023,14, 5155-5162.

4.Zhang, Z.*, Automated Graph Neural Networks Accelerate the Screening of Optoelectronic Properties of Metal–Organic Frameworks.J. Phys. Chem. Lett.2023,14, 1239-1245.

5.Zhang, Z.*Sulfur-Vacancy Passivation Via Selenium Doping in Sb2S3Solar Cells: Density Functional Theory Analysis.J. Phys. Chem. C2022,126, 20786-20792.

6.Zhang, Z.*; Wang, J.; Zhang, Y.; Xu, J.; Long, R.* Charge Recombination Dynamics in a Metal Halide Perovskite Simulated by Nonadiabatic Molecular Dynamics Combined with Machine Learning.J. Phys. Chem. Lett.2022,13, 10734-10740.

7.Zhang, Z.*; Zhang, Y.; Wang, J.; Xu, J.; Long, R.* Doping-Induced Charge Localization Suppresses Electron-Hole Recombination in Copper Zinc Tin Sulfide: Quantum Dynamics Combined with Deep Neural Networks Analysis.J. Phys. Chem. Lett.2021,12, 835-842.

8.Zhang, Z.;Qiao, L.; Mora-Perez, C.; Long, R.*; Prezhdo, O. V.* Pb Dimerization Greatly Accelerates Charge Losses in MAPbI3: Time-Domain Ab Initio Analysis.J. Chem. Phys.2020,152, 064707.

9.Zhang, Z.; Fang, W.-H.; Long, R.*; Prezhdo, O. V.* Exciton Dissociation and Suppressed Charge Recombination at 2D Perovskite Edges: Key Roles of Unsaturated Halide Bonds and Thermal Disorder.J. Am. Chem. Soc.2019,141, 15557-15566.

10.Zhang, Z.; Long, R.* Doping-Induced Rapid Decoherence Suppresses Charge Recombination in Mono/Divalent Cation Mixed Perovskites from Nonadiabatic Molecular Dynamics Simulation.J. Phys. Chem. Lett.2019,10, 3433-3439.

11.Zhang, Z.; He, J.; Long, R.* Ultrafast Charge Separation and Recombination across a Molecule/CsPbBr3Quantum Dot Interface from First-Principles Nonadiabatic Molecular Dynamics Simulation.J. Phys. Chem. C2019,123, 23800-23806.

12.Zhang, Z.; Fang, W.-H.; Tokina, M. V.; Long, R.*; Prezhdo, O. V. Rapid Decoherence Suppresses Charge Recombination in Multi-Layer 2D Halide Perovskites: Time-Domain Ab Initio Analysis.Nano Lett.2018,18, 2459-2466.

13.Zhang, Z.; Liu, L.; Fang, W.-H.; Long, R.*; Tokina, M. V.; Prezhdo, O. V.* Plasmon-Mediated Electron Injection from Au Nanorods into MoS2: Traditional Versus Photoexcitation Mechanism.Chem2018,4, 1112-1127.

14.Zhang, Z.; Long, R.*; Tokina, M. V.; Prezhdo, O. V.* Interplay between Localized and Free Charge Carriers Can Explain Hot Fluorescence in the CH3NH3PbBr3Perovskite: Time-Domain Ab Initio Analysis.J. Am. Chem. Soc.2017,139, 17327-17333.

科研项目:

1.河北省教育厅,青年拔尖人才项目,BJK2024094,基于符号回归的钙钛矿元素特性与材料性能关联研究,2024-01至2026-12,10万元,在研,主持。

2.国家自然科学基金委员会,青年科学基金项目,22103021,基于机器学习的铜锌锡硫太阳能电池光生电荷非绝热分子动力学模拟,2022-01至2024-12,30万元,在研,主持。

3.河北省自然科学基金委员会,青年科学基金项目,B2020201070,碲化镉太阳能电池光生非平衡电荷动力学理论研究,2020-01至2022-12,6万元,已结题,主持。

4.国家自然科学基金委员会,国际(地区)合作与交流项目,51861135101,分子模拟导向的光电化学水解研究:掺杂和表面缺陷在提升廉价光吸收金属氧化物效率的机理性角色,2018-01至2021-12,400万元,已结题,参加(排序第二)。

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