activity
20222026
most citedGeneral analytical nuclear force and molecular potential energy surface from full configuration interaction quantum Monte Carlo

1 citations · 1 across the 5 of their papers we have counts for

collaborators

5 papers

physics.chem-ph2026

Rigorous Quantum Thermodynamics from Entropic Path Integral Coarse-Graining

Jing Shen, Ziyan Ye, Ming-Zheng Du +5

Nuclear quantum effects (NQEs) remain a major challenge for molecular simulations, as rigorous treatment requires imaginary-time path-integral methods with heavy computational over…

physics.chem-ph2026

Efficient Simulation of Non-Markovian Path Integrals via Imaginary Time Evolution of an Effective Hamiltonian

Xiaoyu Yang, Limin Liu, Wencheng Zhao +2

Accurately simulating the non-Markovian dynamics of open quantum systems remains a significant challenge. While the recently proposed time-evolving matrix product operator (TEMPO)…

physics.chem-ph2025

On the role of nuclear quantum effects on the stability of peptides

Jing Shen, Ming-Zheng Du, Dong H. Zhang +2

Nuclear quantum effects (NQEs) arising from the light mass of hydrogen can influence the structure and stability of hydrogen-bonded biomolecules, yet their role in determining pept…

quant-ph2024

Multi-Scale Feature Fusion Quantum Depthwise Convolutional Neural Networks for Text Classification

Yixiong Chen, Weichuan Fang

In recent years, with the development of quantum machine learning, quantum neural networks (QNNs) have gained increasing attention in the field of natural language processing (NLP)…

physics.chem-ph2022★ 1 cited

General analytical nuclear force and molecular potential energy surface from full configuration interaction quantum Monte Carlo

Tonghuan Jiang, Wei Fang, Ali Alavi +1

Full configuration interaction quantum Monte Carlo (FCIQMC) is a state-of-the-art stochastic electronic structure method, providing a methodology to compute FCI-level state energie…