Jitai Yang

Analytic intermolecular potential energy surface and first-principles prediction of the rotational profiles for a symmetric top ion-atom complex: A case study of H3O+-Ar.

D. Hou, Hui Li, Xiao-Long Zhang, 2020, The Journal of chemical physics.

A New Machine Learning Approach Based on Range Corrected Deep Potential Model for Efficient Vibrational Frequency Computation

Hui Li, Yang Cong, Jitai Yang, 2023, 2303.15969.

Quantum Vibration Perturbation Approach with Poly-atomic Probe in Simulating Infrared Spectra

Jiali Gao, Hui Li, Adam Grofe, 2021, Physical Chemistry Chemical Physics.

A new permutation-symmetry-adapted machine learning diabatization procedure and its application in MgH2 system.

Zexing Qu, Hui Li, Yu Zhai, 2021, The Journal of chemical physics.

Machine Learning Approach Based on a Range-Corrected Deep Potential Model for Efficient Vibrational Frequency Computation.

Hui Li, Yang Cong, Jitai Yang, 2023, Journal of chemical theory and computation.