Ground-state properties via machine learning quantum constraints
Pei-Lin Zheng, Si-Jing Du, Yi Zhang

TL;DR
This paper introduces a machine learning approach that uses quantum constraints on operator expectation values to efficiently determine ground-state properties of quantum many-body systems, bypassing the need for full state computation.
Contribution
It presents a novel method leveraging quantum constraints and machine learning to analyze ground states without directly computing the exponentially large Hilbert space.
Findings
Effective for strongly correlated systems
Applicable to thermodynamic-limit systems
Shows advantages over traditional methods
Abstract
Ground-state properties are central to our understanding of quantum many-body systems. At first glance, it seems natural and essential to obtain the ground state before analyzing its properties; however, its exponentially large Hilbert space has made such studies costly, if not prohibitive, on sufficiently large system sizes. Here, we propose an alternative strategy based upon the expectation values of an ensemble of operators and the elusive yet vital quantum constraints between them, where the search for ground-state properties simply equates to classical constrained minimization. These quantum constraints are generally obtainable via sampling and then machine learning on a large number of systematically consistent quantum many-body states. We showcase our perspective on 1D fermion chains and spin chains for applicability, effectiveness, caveats, and unique advantages, especially for…
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Taxonomy
TopicsMachine Learning in Materials Science · Quantum many-body systems · Advanced Chemical Physics Studies
