2 papers
cond-mat.mtrl-sci2026
Uni2D: A Universal Machine Learning Interatomic Potential for Two-Dimensional Materials
Haidi Wang, Yufan Yao, Haonan Song +7
Accurate interatomic potentials (IAPs) are essential for modeling the potential energy surfaces (PES) that govern atomic interactions in materials. However, most existing IAPs are…
cond-mat.mes-hall2025
High-throughput calculations of two-dimensional auxetic with magnetism, electrocatalysis, and alkali metal battery applications
Haidi Wang, Wei Lin, Weiduo Zhu +3
Two-dimensional (2D) materials with multifunctional properties, such as negative Poisson's ratio (NPR), magnetism, catalysis, and energy storage capabilities, are of significant in…