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Joshua W. Dai

Publications and source records attributed to Joshua W. Dai.

3 recordsLinked to original sources

Structure-Aware Variance Reduction for Unbiased Randomized Hamiltonian Simulation

Randomized Hamiltonian simulation methods are often governed by a trade-off between systematic bias and sampling overhead. We study how classical variance-reduction techniques can be applied to such methods without changing their mean channel, and therefore without introducing additional bias. As a motivating unbiased estimator, we formulate continuous time-evolution probabilistic angle interpolation (continuous TE-PAI), a quasiprobabilistic random-circuit protocol whose remaining Monte Carlo error is purely statistical. Continuous TE-PAI removes Trotter discretization error with finite-depth random circuits, whereas deterministic Trotterization does so only in the infinite-depth limit. Further, in tensor-network simulations, we demonstrate that discretization error can cause an unphysical exponential growth in the bond dimension required for Trotterized simulations, whereas comparable-depth continuous TE-PAI circuits avoid this growth. We then show that the variance of randomized product-formula-based estimators admits a canonical decomposition into a classical counting component and a quantum ordering component such that the dominant simulation overhead results from the non-commutative parts of the Hamiltonian dynamics. Motivated by this decomposition, we achieve an $\approx70\%$ error-reduction using the counting-component for small systems whereas our tensor-network simulations of $n=30$ spin-chain dynamics use coarser statistics tailored to the observable and estimator attaining a negligible bias and a reduction of $\approx 80\%$ leading to $\approx91\%$ and $\approx96\%$ sampling-cost reductions, respectively.

quant-ph

Stratified Sampling for Quasi-Probability Decompositions

Quasi-probability decompositions (QPDs) have proven essential in many quantum algorithms and protocols -- one replaces a ``difficult'' quantum circuit with an ensemble of ``easier'' circuit variants whose weighted outcomes reproduce any target observable. This, however, inevitably yields an increased configuration variance beyond Born-rule shot noise. We develop a broad framework for accounting for and reducing this variance and prove that stratified sampling -- under ideal proportional allocation -- results in an unbiased estimator with a variance that is never worse than naïve sampling (with equality only in degenerate cases). Furthermore, we provide a classical dynamic programme to enable stratification on arbitrary product-form QPDs. Numerical simulations of typical QPDs, such as Probabilistic Error Cancellation (PEC) and Probabilistic Angle Interpolation (PAI), demonstrate constant-factor reductions in overall variance (up to $\sim 60$--$80\%$ in an oracle model) and robust $\sim 10\%$ savings in the pessimistic single-shot regime. Our results can be applied immediately to reduce the net sampling cost of practically relevant QPDs that are commonly used in near term and early fault-tolerant algorithms without requiring additional quantum resources.

quant-ph

Chemically-Accurate Prediction of the Ionisation Potential of Helium Using a Quantum Processor

Quantum computers have the potential to revolutionise our understanding of the microscopic behaviour of materials and chemical processes by enabling high-accuracy electronic structure calculations to scale more efficiently than is possible using classical computers. Current quantum computing hardware devices suffer from the dual challenges of noise and cost, which raises the question of what practical value these devices might offer before full fault tolerance is achieved and economies of scale enable cheaper access. Here we examine the practical value of noisy quantum computers as tools for high-accuracy electronic structure, by using a Quantinuum ion-trap quantum computer to predict the ionisation potential of helium. By combining a series of techniques suited for use with current hardware including qubit-efficient encoding coupled with chemical insight, low-cost variational optimisation with hardware-adapted quantum circuits, and moments-based corrections, we obtain an ionisation potential of 24.5536 (+0.0011, -0.0005) eV, which agrees with the experimentally measured value to within true chemical accuracy, and with high statistical confidence. The methods employed here can be generalised to predict other properties and expand our understanding of the value that might be provided by near-term quantum computers.

quant-ph