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arXiv:2605.14672

AQKA: Active Quantum Kernel Acquisition Under a Shot Budget

Jian Xu, Chao Li, Delu Zeng, John Paisley, Qibin Zhao

Published May 14, 2026• 0 citations
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Abstract

Estimating an $N \times N$ quantum kernel from circuit fidelities requires $Θ(N^2 S)$ measurement shots, the dominant bottleneck for deployment on near-term hardware. Existing budget-saving methods (Nyström-QKE, ShoFaR, kernel-target alignment) sub-sample \emph{which} entries to measure but allocate shots \emph{uniformly} within their chosen subset, ignoring how much each entry drives the downstream classifier. We close this gap with two contributions. \textbf{First, a complete regime decomposition} for shot-budgeted quantum kernel learning: a principled menu of when each allocator wins. Our method, \emph{AQKA}, dominates the budget-limited regime ($B \lesssim 16 n_{\mathrm{pairs}}$) on sparse-sensitivity KRR, with the gap \emph{growing} from $+8$ to $+25$ pts over uniform as $N$ scales $225{\to}1000$ and reaching $+26$--$32$ pts on an \texttt{ibm\_pittsburgh} (156-qubit Heron) hardware kernel; Nyström-QKE wins at saturating budgets on planted-sparse via low-rank reconstruction; ShoFaR is competitive only at extreme low budgets. \textbf{Second, a closed-form pair-level acquisition theory}: $s_{ij}^{\star} \propto |g_{ij}|\sqrt{K_{ij}(1-K_{ij})}$ with explicit gradient $g_{ij}$ for KRR (Lemma~1, $|β_iα_j+β_jα_i|\sqrt{K_{ij}(1-K_{ij})}$) and SVM via the envelope theorem ($|η_i^*η_j^*|\sqrt{K_{ij}(1-K_{ij})}$); a \emph{corrected} sparsity-aware Cauchy--Schwarz rate $ρ\le 2m/N$ matching empirics (vs.\ the naive $m^2/N^2$); an explicit-constant plug-in regret bound (Theorem~2); and a tighter SVM ceiling $ρ^{\mathrm{SVM}} \le m_{\mathrm{sv}}^2/N^2$. We close with the first multi-seed live online adaptive shot allocation on quantum hardware: $+17.0 \pm 4.8$ pts at $N{=}20$ on \texttt{ibm\_aachen} ($3.5σ$, 5 seeds), with the advantage holding at $N{=}30$ at higher budget on \texttt{ibm\_berlin} ($+14.0 \pm 8.5$ pts, 5 seeds).

DOI
10.48550/arxiv.2605.14672

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Quantum kernel estimation on near-term hardware is shot-budgeted: every entry of the kernel Gram matrix is a Bernoulli expectation that must be sampled with a finite number of circuit executions. Recent work on quantum kernel classification has shown that allocating shots non-uniformly across kernel entries, weighted by their downstream task sensitivity, can reduce the shot budget required to reach a target accuracy. We extend this idea to Gaussian process (GP) regression, a setting whose downstream quantities (full-spectrum posterior variance, log-determinant, marginal likelihood) couple to kernel error more tightly than the sign-only outputs of classification. We derive three closed-form pair-level sensitivities predictive coupling ∣αiαj∣|α_iα_j|∣αi​αj​∣, leave-one-out residual, and marginal-likelihood gradient and plug them into a Neyman-style minimum-variance allocation rule. To prevent catastrophic over-concentration when the warm-up sensitivity estimate is itself noisy, we add a high uniform coverage floor justified by a Frobenius lower bound on the missing-entry perturbation. On four UCI benchmarks and two synthetic RBF + Bernoulli controlled studies, the resulting allocator delivers 101010--21%21\%21% test-RMSE improvement over uniform allocation across the moderate-budget regime. The gain transfers (i) to genuine ZZ and Pauli-Z quantum kernels on quantum-natural data (−13-13−13--15%15\%15% at low budget, p<0.05p<0.05p<0.05 paired) and (ii) to four downstream tasks (Bayesian quadrature, heteroscedastic regression, hyperparameter learning, multi-output Cokriging). On UCI features embedded into a ZZ kernel the gain disappears, consistent with the exponential-concentration regime where shot allocation has nothing to exploit.
Quantum kernel methods have been proposed as a promising approach for leveraging near-term quantum computers for supervised learning, yet rigorous benchmarks against strong classical baselines remain scarce. We present a comprehensive empirical study of quantum kernel support vector machines (QSVMs) across nine binary classification datasets, four quantum feature maps, three classical kernels, and multiple noise models, totalling 970 experiments with strict nested cross-validation. Our analysis spans four phases: (i) statistical significance testing, revealing that none of 29 pairwise quantum-classical comparisons reach significance at α=0.05α= 0.05α=0.05; (ii) learning curve analysis over six training fractions, showing steeper quantum slopes on six of eight datasets that nonetheless fail to close the gap to the best classical baseline; (iii) hardware validation on IBM ibm_fez (Heron r2), demonstrating kernel fidelity r≥0.976r \geq 0.976r≥0.976 across six experiments; and (iv) seed sensitivity analysis confirming reproducibility (mean CV 1.4%). A Kruskal-Wallis factorial analysis reveals that dataset choice dominates performance variance (ε2=0.73\varepsilon^2 = 0.73ε2=0.73), while kernel type accounts for only 9%. Spectral analysis offers a mechanistic explanation: current quantum feature maps produce eigenspectra that are either too flat or too concentrated, missing the intermediate profile of the best classical kernel, the radial basis function (RBF). Quantum kernel training (QKT) via kernel-target alignment yields the single competitive result -- balanced accuracy 0.968 on breast cancer -- but with ~2,000x computational overhead. Our findings provide actionable guidelines for quantum kernel research. The complete benchmark suite is publicly available to facilitate reproduction and extension.
Quantum kernel estimation (QKE) lets a quantum computer supply the similarity values a classical support vector machine needs, but the original hardware demonstration is hard to reproduce and gives little guidance on the number of shots a usable kernel requires. This study implements QKE on a two-qubit simulator and quantifies its shot and noise requirements. A second-order ZZ feature map encodes each data point, kernel entries are measured from an overlap circuit, and a classical support vector machine is trained on the resulting matrix. An artificial dataset of 40 training and 40 test points was generated with a separation gap of 0.3, the shot count was varied from 128 to 50,000, and a depolarising and readout noise model was applied; classical kernels and a variational classifier served as baselines. With an exactly computed kernel the classifier labels every training and test point correctly using 12 support vectors. Perfect test accuracy is reached at 1,024 shots per pair, far below the 50,000 used on hardware, and the deviation from the exact kernel decays with a fitted exponent of -0.52. The weight of negative eigenvalues falls from 2.019 to 0.096 as shots increase, making it a practical warning sign of too few shots. Under noise the kernel values drop by 0.014 on average, yet accuracy stays at 100% because the drop is nearly uniform. Classical kernels reach at most 70% test accuracy and the variational classifier 98.3%. The work contributes a reproducible open-source procedure and shot-budget guidance for quantum kernel experiments.
Quantum kernel methods are the most concrete near-term proposal for quantum machine learning on classical data, yet published benchmarks disagree on whether they outperform tuned classical kernels, and the disagreement cannot be resolved from the literature because the comparisons are not protocol-controlled. We argue that the obstacle is one of measurement, not theory: the usual setup fixes the quantum feature map's data scaling while grid-searching the classical kernel's hyperparameters, recomputes nothing per fold, and reports cost in simulator time. We therefore treat the comparison itself as the object of study and impose three controls. The bandwidth is tuned on the same grid budget as the classical γγγ, the kernel is recomputed inside every fold from fold-fitted preprocessing, and cost is counted in hardware circuit evaluations. On top of these we run a factorial design of 324 cells in which dimensionality, training size, class separability and data structure are explicit covariates, together with four standard datasets, a shots-versus-gate-noise ablation, and a cost sweep. The dominant effect we measure is not quantum: tuning the feature map's bandwidth is worth 0.120 accuracy on synthetic data and 0.339 on real data, exceeding every quantum-classical difference we observe. Tuned quantum kernels are then statistically indistinguishable from a tuned RBF on all four real datasets. The advantage on synthetic data is confined almost entirely to data generated by the feature map itself, and it shrinks with dimensionality (-0.0045 per qubit) while growing with sample size. Finite sampling costs an order of magnitude more accuracy than gate and readout noise, and a fidelity kernel needs 5×1075\times10^{7}5×107 circuits at n = 10,000. Protocol variance is thus sufficient to explain the field's contradictory conclusions.
Quantum kernel methods are a candidate for quantum speed-ups in supervised machine learning. The number of quantum measurements N required for a reasonable kernel estimate is a critical resource, both from complexity considerations and because of the constraints of near-term quantum hardware. We emphasize that for classification tasks, the aim is reliable classification and not precise kernel evaluation, and demonstrate that the former is far more resource efficient. Furthermore, it is shown that the accuracy of classification is not a suitable performance metric in the presence of noise and we motivate a new metric that characterizes the reliability of classification. We then obtain a bound for N which ensures, with high probability, that classification errors over a dataset are bounded by the margin errors of an idealized quantum kernel classifier. Using chance constraint programming and the subgaussian bounds of quantum kernel distributions, we derive several Shot-frugal and Robust (ShofaR) programs starting from the primal formulation of the Support Vector Machine. This significantly reduces the number of quantum measurements needed and is robust to noise by construction. Our strategy is applicable to uncertainty in quantum kernels arising from any source of unbiased noise.
Reporting the Fisher geometry of a trained variational quantum model is routine; quoting the shot budget that would establish it is not. Certifying an empirical Fisher matrix to relative Frobenius error ε\varepsilonε under coordinate-wise parameter shift costs Θ(Bp2V/(ε2G))Θ(B p^{2} V/(\varepsilon^{2} G))Θ(Bp2V/(ε2G)) circuit executions, where VVV is the measured readout variance and GGG the measured squared gradient norm, with uniform allocation optimal in that class. One constant reproduces the cost of two circuit families whose exponents differ by a full power of ppp. The exponent is an identity in how nVnVnV and nGnGnG scale with the register, holding family by family to 0.0010.0010.001 across 624 matrix-product-state cells once the finite-ppp prefactor is removed. The cubic cost is therefore a finite-size window, set by whether the readout light cone grows with the register. A product family to 256 qubits gives 1.9661.9661.966 (95% CI 1.9341.9341.934--1.9971.9971.997); a brickwork entangler falls from 2.8532.8532.853 below ten qubits to 1.7151.7151.715 beyond sixty-four; a blocked entangler gives 1.9841.9841.984 at a fixed cone width against 3.0343.0343.034 at a proportional one. Fixed device connectivity fixes the cone, so a cubic budget from a small simulation overestimates a large machine, on top of hardware multipliers 2.07×2.07\times2.07× (1.411.411.41--3.023.023.02), 2.38×2.38\times2.38× and 1.91×1.91\times1.91× on ibm_marrakesh, ibm_fez and ibm_kingston. Cost-optimal readout weights cut the measured shot budget by 2.67×2.67\times2.67× (1.331.331.33--4.004.004.00) on hardware, flat from four to twelve qubits. A discrepancy model fitted on cheap circuits transfers its mean inside the calibration grid and, at six larger sizes named before the data, does not: nominal 90% intervals cover 36%, and split conformal is the only rung that stays near nominal.