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Unbiased KL-divergence estimator for high-entropy quantum-simulation distributions

Develop an unbiased estimator for the Kullback–Leibler divergence, in either direction KL[p, p~] or KL[p~, p], that remains accurate and informative for large-scale, high-entropy probability distributions produced by computational-basis measurements of quenches in the transverse-field Ising model, so divergence between quantum annealer output distributions and ground-truth distributions can be quantified without requiring exponentially many samples.

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Background

To assess the closeness between distributions obtained from the quantum annealer and classical ground-truth simulations, the authors examined various divergence measures (cross entropy, KL divergences, classical fidelity). Because the entropy of the distributions grows with the number of spins, sampling-based estimates become impractical at larger sizes.

The authors ultimately relied on a correlation-based metric because they could not identify an unbiased, practically informative estimator for KL divergence suitable for the high-entropy regime relevant to their experiments. A robust estimator would enable principled benchmarking without incurring exponentially growing sample complexity.

References

Due to entropy scaling with system size, we could not formulate an unbiased estimator for either form of KL-divergence that was informative on larger problems. We found that several estimators exhibit related issues, including the classical fidelity.

Computational supremacy in quantum simulation (2403.00910 - King et al., 1 Mar 2024) in Supplementary Materials, Section 'Measuring the quality of sampled distributions'