MPS-VMC: A high-performance matrix product state variational Monte Carlo Solver for ab initio quantum chemistry

Zhiqian Xu 0005, Yangjun Wu, Lizhong Fu, Chu Guo, Honghui Shang. MPS-VMC: A high-performance matrix product state variational Monte Carlo Solver for ab initio quantum chemistry. Computer Physics Communications, 322:110057, 2026. [doi]

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