PROJECTS

1.   Metal-oxide interaction descriptor based on first-principles neural network potential function, PI S. L. Hu

      基于第一性原理神经网络势函数的金属与氧化物相互作用描述符

      Special funding from China Postdoctoral Fund,Jan 2022 - Dec 2023

2.   Big data-driven carbon resource catalysis foundation, PI W. X. Li

      基于大数据驱动的碳资源催化作用基础

      Chinese Academy of Sciences K. C. Wong Education Talent Plan Lu Jiaxi International Team, GJTD-2020-15,

      Jan 2021 - Dec 2023

3.   Rational computational design of OX-ZEO catalyst for syngas conversion, PI J. X. Liu

      氧化物-分子筛催化剂合成气转化的理性设计

      USTC Research Funds of the Double First-Class Initiative, YD2060002012, Jan 2021 - Dec 2022

4.  Theoretical and computational catalysis, PI J. X. Liu

     理论与计算催化

     The start-up funds of University of Science and Technology of China, KY2060000171, Sep 2020 - Aug 2023

5. Theoretical investigation of the reaction mechanism of syngas conversion on OX-ZEO composite catalysts, PI W. X. Li

     合成气转化OX-ZEO反应机理的理论计算

     National Natural Science Foundation of China, 91945302, Jan 2020 - Dec 2022

6.  Structure and size effects of ceria supported Pt particles using first-principles neural network potential, PI S. L. Hu

     基于第一性原理神经网络势函数的CeO2负载铂纳米粒子结构和尺寸效应研究

     National Natural Science Foundation of China, Jan 2020 - Dec 2022

7.  Control crystalline phase and stability of nanocatalysts, PI W. X. Li

     纳米催化材料的晶相和稳定性调控

     Key Project of Frontier Science of CAS, QYZDJ-SSW-SLH054, Jan 2018 - Dec 2022

FUNDING AGENCY

National Natural Science Foundation of China    

国家自然科学基金委员会

     CHINESE ACADEMY OF SCIENCE 

     中国科学院

     University of Science and Technology of China

     中国科学技术大学