Sign-Problem-Free Nuclear Quantum Monte Carlo Simulation
Abstract
Quantum Monte Carlo (QMC) methods offer exact solutions for quantum many-body systems but face severe limitations in fermionic systems like atomic nuclei due to the sign problem. While sign-problem-free QMC algorithms exist and provide valuable insights across disciplines, they have been restricted to simple models with limited quantitative predictive power. Here we overcome this barrier by developing a novel lattice nuclear force that is rigorously sign-problem-free for even-even nuclei. This interaction achieves a standard deviation of MeV from experimental binding energies for 76 even-even nuclei (), matching state-of-the-art phenomenological mean-field models. Key innovations include the first sign-problem-free implementation of spin-orbit coupling for shell evolutions and an efficient QMC-optimized framework for global parameter fitting. Using this approach, we compute binding energies from He to Sn with unprecedented one-thousandth level numerical precision, reproduce symmetric nuclear matter saturation, and reveal novel spin-orbit-driven clustering in light nuclei. This work transforms sign-problem-free QMC into a scalable and predictive nuclear structure tool, while establishing a high-fidelity, non-perturbative foundation for \textit{ab initio} calculations of heavy nuclei.
Cite
@article{arxiv.2506.12874,
title = {Sign-Problem-Free Nuclear Quantum Monte Carlo Simulation},
author = {Zhong-Wang Niu and Bing-Nan Lu},
journal= {arXiv preprint arXiv:2506.12874},
year = {2026}
}
Comments
7 pages, 4 figures and 1 table, 25 pages supplemental materials combined. Accepted for publication in PRL