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ZHOU Yuanyuan
Associate Professor
zhouyy3@sustech.edu.cn

Brief Introduction

Yuanyuan Zhou, Associate Professor in SUSTech. She obtained her Bachelor degree (2012) and Master degree (2015) supervised by Prof. Yanming Ma in Jilin University, then she moved to Berlin Germany and obtained her PhD degree (2020) mentored by Prof. Matthias Scheffler and Prof. Luca M. Ghiringhelli in  Fritz Haber institute (FHI) of Max Planck Society. After 1-year working as research associate in FHI, she moved to Copenhagen Denmark and conducted 3-year postdoctoral research advised by Prof Jens K.  N?rskov and collaborated with Prof. Ib Chorkendorff in Technical University of Denmark. Afterwards, she joined Leibniz-Institut für Kristallzüchtung as a junior group leader in 2024.  Dr. Zhou is mainly interested in developing methods encompassing machine learning, enhanced sampling, statistical learning, and free energy estimation for surface/interfacial phenomena including semiconductor oxide thin film growth, quantum material thin film growth and electrochemical ammonia synthesis, etc.  


Research Interests

◆AI4Surface

◆Statistical Learning

◆Large-Scale Simulation


Educational Background

◆2015– 2020 Ph.D. in Theoretical Physics with Summe cum laude,

 supervisor: Matthias Scheffler and Luca M. Ghiringhelli, Fritz Haber Institute of the Max Planck Society/Technical University of Berlin, Berlin, Germany

◆2012– 2015 M.S. in Condensed Matter Physics with Grade A,

 supervisor: Yanming Ma,

 Jilin University, Changchun, China

◆2008– 2012 B.S. in Physics with 95/100, in Finance (minor), Jilin University, Changchun, China

 supervisor: Yanming Ma,


Professional Experience

◆2025.04– now Associate Professor, Department of Physics, Southern University of Science and Technology, Shenzhen, China

◆2024.07– 2024.12 Junior group leader, Department of Material Science, Leibniz-Institut für Kristallzüchtung, Berlin, Germany

◆2021.06– 2024.05 Postdoc working with Jens K. N?rskov, Catalysis Theory Center, Department of Physics, Technical University of Denmark, Copenhagen, Denmark

◆2020.04– 2021.04 Research associate working with Matthias Scheffler, NOMAD Laboratory, Fritz Haber Institute of the Max Planck Society, Berlin, Germany


Selected Publications

?: co-first author;*:Corresponding author

1.Xianbiao Fu? , Jakob B. Pedersen? , Yuanyuan, Zhou? , Mattia Saccoccio, Shaofeng Li, Rokas Sa?inas, Katja Li, Suzanne Z. Andersen, Niklas H. Deissler, Aoni Xu, Jon Bjarke Valb?k Mygind, Chao Wei, Debasish Chakraborty, Jakob Kibsgaard, Peter C. K. Vesborg, Jens K. N?rskov*, and Ib Chorkendorff* “Continuous flow electrosynthesis of ammonia by nitrogen reduction and hydrogen oxidation” Science 379, 707–712, (2023)

2.Yuanyuan,Zhou*,ChunyeZhu,MatthiasSchefflerandLucaM.Ghringhelli“Abinitioapproach for thermodynamic surface phases with full consideration of anharmonic effects– the example of hydrogen at Si(100) ” Phys. Rev. Lett., 128, 246101 (2022)

3.Yuanyuan, Zhou*, Matthias Scheffler and Luca M. Ghringhelli* “Dertermining phase diagram including anharmonic effects” Phys. Rev. B 100, 174106 (2019) Editor suggestions

4.Wenhui Mi, Xuecheng Shao, Chuanxun Su, Yuanyuan, Zhou, Shoutao Zhang, Quan Li, Hui Wang, Lijun Zhang, Maosheng Miao, Yanchao Wang*, and Yanming Ma* “A Real-Space Finite-Difference Implementation of Orbital-Free Density Functional Theory” Comput. Phys. Commun. 200, 87(2016)


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