Publications

My full publication list can be found in my Google Scholar.

2025

  1. An Automated Framework for Exploring and Learning Potential-Energy Surfaces
    Yuanbin Liu, Joe D. Morrow, Christina Ertural, and 6 more authors
    Nat. Commun., Aug 2025
    DOI
  2. Full-Cycle Device-Scale Simulations of Memory Materials with a Tailored Atomic-Cluster-Expansion Potential
    Yuxing Zhou, Daniel F. Thomas du Toit, Stephen R. Elliott, and 2 more authors
    Nat. Commun., Sep 2025
    DOI

2024

  1. Hyperparameter Optimization for Atomic Cluster Expansion Potentials
    Daniel F. Thomas du Toit, Yuxing Zhou, and Volker L. Deringer
    J. Chem. Theory Comput., Nov 2024
    DOI

2023

  1. Surface Effects on the Crystallization Kinetics of Amorphous Antimony
    Xueyang Shen, Yuxing Zhou, Hanyi Zhang, and 3 more authors
    Nanoscale, Sep 2023
    DOI
  2. Structure and Bonding in Amorphous Red Phosphorus
    Yuxing Zhou, Stephen R. Elliott, and Volker L. Deringer
    Angew. Chem. Int. Ed., 2023
    DOI
  3. Device-Scale Atomistic Modelling of Phase-Change Memory Materials
    Yuxing Zhou, Wei Zhang, En Ma, and 1 more author
    Nat. Electron., Oct 2023
    DOI

2022

  1. Unraveling Crystallization Mechanisms and Electronic Structure of Phase-Change Materials by Large-Scale Ab Initio Simulations
    Yazhi Xu, Yuxing Zhou, Xudong Wang, and 4 more authors
    Adv. Mater., Mar 2022
    DOI
  2. Cluster Fragments in Amorphous Phosphorus and Their Evolution under Pressure
    Yuxing Zhou, W. Kirkpatrick, and V. L. Deringer
    Adv. Mater., Feb 2022
    DOI

2021

  1. Unraveling the Optical Contrast in Sb2Te and AgInSbTe Phase-Change Materials
    Shehzad Ahmed, Xu-Dong Wang, Yuxing Zhou, and 3 more authors
    J. Phys. Photonics, Jun 2021
    DOI
  2. Change in Structure of Amorphous Sb–Te Phase-Change Materials as a Function of Stoichiometry
    Shehzad Ahmed, Xudong Wang, Heming Li, and 5 more authors
    Phys. Status Solidi RRL, 2021
    DOI
  3. Ab Initio Molecular Dynamics and Materials Design for Embedded Phase-Change Memory
    Liang Sun, Yuxing Zhou, Xu-Dong Wang, and 4 more authors
    npj Comput. Mater., Feb 2021
    DOI
  4. Bonding Nature and Optical Contrast of TiTe2/Sb2Te3 Phase-Change Heterostructure
    Xudong Wang, Yue Wu, Yuxing Zhou, and 2 more authors
    Mater. Sci. Semicond. Proc., Nov 2021
    DOI
  5. Enhancing Thermoelectric Performance of Sb2Te3 through Swapped Bilayer Defects
    Jiangjing Wang, Chongjian Zhou, Yuan Yu, and 9 more authors
    Nano Energy, Jan 2021
    DOI
  6. Materials Screening for Disorder-Controlled Chalcogenide Crystals for Phase-Change Memory Applications
    Yazhi Xu, Xudong Wang, Wwei Zhang, and 10 more authors
    Adv. Mater., Mar 2021
    DOI
  7. Structure and Dynamics of Supercooled Liquid Ge2Sb2Te5 from Machine-learning-driven Simulations
    Yuxing Zhou, Han-Yi Zhang, Volker L. Deringer, and 1 more author
    Phys. Status Solidi RRL, 2021
    DOI

2020

  1. Chemical Understanding of Resistance Drift Suppression in Ge–Sn–Te Phase-Change Memory Materials
    Yuhan Chen, Liang Sun, Yuxing Zhou, and 4 more authors
    J. Mater. Chem. C, 2020
    DOI
  2. In Situ Study of Vacancy Disordering in Crystalline Phase-Change Materials under Electron Beam Irradiation
    Ting-Ting Jiang, Xu-Dong Wang, Jiang-Jing Wang, and 7 more authors
    Acta Mater., 2020
    DOI
  3. Bonding Similarities and Differences between Y–Sb–Te and Sc–Sb–Te Phase-Change Memory Materials
    Yuxing Zhou, Liang Sun, Getasew M. Zewdie, and 4 more authors
    J. Mater. Chem. C, 2020
    DOI

2019

  1. Phase-Change Heterostructure Enables Ultralow Noise and Drift for Memory Operation
    Keyuan Ding, Jiangjing Wang, Yuxing Zhou, and 7 more authors
    Science, Oct 2019
    DOI
  2. Chemical Design Principles for Cache-Type Sc–Sb–Te Phase-Change Memory Materials
    Getasew M. Zewdie, Yuxing Zhou, Liang Sun, and 4 more authors
    Chem. Mater., 2019
    DOI

2017

  1. Reducing the Stochasticity of Crystal Nucleation to Enable Subnanosecond Memory Writing
    F. Rao, K. Ding, Yuxing Zhou, and 9 more authors
    Science, Dec 2017
    DOI