Noiseless limit and improved-prior limit of the maximum entropy method and their implications for the analytic continuation problem

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Authors: Thomas M. Chuna, Nicholas Barnfield, Paul Hamann, Sebastian Schwalbe, Michael P. Friedlander, Tobias Dornheim
Cited by: 1
References: 66

Abstract

Quantum Monte Carlo (QMC) methods are uniquely capable of providing exact simulations of quantum many-body systems. Unfortunately, the applications of a QMC simulation are limited because extracting dynamic properties requires solving the analytic continuation problem. Across the many fields that use QMC methods, there is no universally accepted analytic continuation algorithm for extracting dynamic properties, but many publications compare to the maximum entropy method. We investigate when entropy maximization is an acceptable approach. We show that stochastic sampling algorithms reduce to entropy maximization when the Bayesian prior is near to the true solution. We investigate when is Bryan’s controversial optimization algorithm [Bryan, for entropy maximization (sometimes known as the maximum entropy method—MEM) appropriate to use. We show that Bryan’s algorithm is appropriate when the noise is near zero or when the Bayesian prior is near the true solution. We also investigate the mean squared error, finding a better scaling when the Bayesian prior is near the true solution than when the noise is near zero. Together, these three results indicate that enhancing the quality of the Bayesian prior enhances the validity of the MEM and has better return on investment than reducing the noise. We point to examples of improved data-driven Bayesian priors that have already leveraged this advantage. We support these results by solving the double Gaussian problem using both Bryan’s algorithm and the newly formulated dual approach to entropy maximization [Chuna , .

Fields of Study & Subjects

Quantum many-body systems Protein Structure and Dynamics Statistical Mechanics and Entropy

Publication details

Journal / source
Physical Review Research
Publisher
American Physical Society (APS)
Volume
8
Issue
3
Publication date
11 May 2026
Language
EN