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SuperSalt: Equivariant Neural Network Force Fields for Multicomponent Molten Salts System
Chen Shen, Siamak Attarian, Yixuan Zhang +4
Molten salts are crucial for clean energy applications, yet exploring their thermophysical properties across diverse chemical space remains challenging. We present the development…
Stable diffusion for the inverse design of microstructures
Yixuan Zhang, Teng Long, Hongbin Zhang
In materials science, microstructures and their associated extrinsic properties are critical for engineering advanced structural and functional materials, yet their robust reconstr…
Generative deep learning for the inverse design of materials
Teng Long, Yixuan Zhang, Hongbin Zhang
In addition to the forward inference of materials properties using machine learning, generative deep learning techniques applied on materials science allow the inverse design of ma…
Kalman filter enhanced Adversarial Bayesian optimization for active sampling in inelastic neutron scattering
Nihad Abuawwad, Yixuan Zhang, Samir Lounis +1
Spin waves, or magnons, are fundamental excitations in magnetic materials that provide insights into their dynamic properties and interactions. Magnons are the building blocks of m…