2 papers
physics.chem-ph2026
Refinement and Performance Benchmark for Range-Separated Water Force Field
Qian Gao, Junmin Chen, Kuang Yu
In our previous work, we developed a CCSD(T)-level range-separated water force field that combines the power of physics-driven and machine learning models. However, it was found th…
physics.chem-ph2025
A Hybrid Physics-Driven Neural Network Force Field for Liquid Electrolytes
Junmin Chen, Qian Gao, Yange Lin +6
Electrolyte design plays an important role in the development of lithium-ion batteries and sodium-ion batteries. Battery electrolytes feature a large design space composed of diffe…