Zheyong Fan

机构：Suzhou Research Institute, Bohai University · ORCID：0000-0002-2253-8210

发表论文 232 篇 · 总被引 6017 次 · h-index 40

代表论文

• NepTrain and NepTrainKit: Automated active learning and visualization toolkit for neuroevolution potentials (2025 · Computer Physics Communications · 被引 28)
• PYSED: A tool for extracting kinetic-energy-weighted phonon dispersion and lifetime from molecular dynamics simulations (2025 · Journal of Applied Physics · 被引 23)
• NEP-MB-pol: a unified machine-learned framework for fast and accurate prediction of water’s thermodynamic and transport properties (2025 · npj Computational Materials · 被引 21)
• NEP89: universal neuroevolution potential for inorganic and organic materials across 89 elements (2026 · Nature Computational Science · 被引 17)
• Probing the ideal limit of interfacial thermal conductance in two-dimensional van der Waals heterostructures (2025 · npj Computational Materials · 被引 11)
• qNEP: A Highly Efficient Neuroevolution Potential with Dynamic Charges for Large-Scale Atomistic Simulations (2026 · Journal of Chemical Theory and Computation · 被引 7)