Unbiasing fermionic auxiliary-field quantum Monte Carlo with matrix product state trial wavefunctions

In this work, we report, for the first time, an implementation of fermionic auxiliary-field quantum Monte Carlo (AFQMC) using matrix product state (MPS) trial wavefunctions, dubbed MPS-AFQMC. Calculating overlaps between an MPS trial and arbitrary Slater determinants up to a multiplicative error, a...

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Bibliographic Details
Main Authors: Tong Jiang, Bryan O'Gorman, Ankit Mahajan, Joonho Lee
Format: Article
Language:English
Published: American Physical Society 2025-01-01
Series:Physical Review Research
Online Access:http://doi.org/10.1103/PhysRevResearch.7.013038
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