Computational Chemistry | Materials Science Machine-Learning-Based Interatomic Potentials for Group IIB to VIA Semiconductors: Toward a Universal Model. June 20, 2024
Chemistry | Geology | Material Science Speciation of La-Cl Complexes in Hydrothermal Fluids from Deep Potential Molecular Dynamics. October 9, 2023
Biochemistry | Chemistry Solvation structures of calcium and magnesium ions in water with the presence of hydroxide: a study by deep potential molecular dynamics. December 15, 2022
Chemistry | Machine Learning | Quantum Mechanics DeePKS + ABACUS as a Bridge between Expensive Quantum Mechanical Models and Machine Learning Potentials. December 1, 2022
Chemistry | Materials Science | Molecular Modeling DP Compress: A Model Compression Scheme for Generating Efficient Deep Potential Models. August 4, 2022