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Daniel K. Park

Publications and source records attributed to Daniel K. Park.

At least 19 recordsLinked to original sources

Re-uploading quantum data: a universal function approximator for quantum inputs

Quantum data re-uploading has proved powerful for classical inputs, where repeatedly encoding features into a small circuit yields universal function approximation. Extending this idea to quantum inputs remains underexplored, as the information contained in a quantum state is not directly accessible in classical form. We propose and analyze a quantum data re-uploading architecture in which a qubit interacts sequentially with fresh copies of an arbitrary input state. The circuit can approximate any bounded continuous function using only one ancilla qubit and single-qubit measurements. By alternating entangling unitaries with mid-circuit resets of the input register, the architecture realizes a discrete cascade of completely positive and trace-preserving maps, analogous to collision models in open quantum system dynamics. Our framework provides a qubit-efficient and expressive approach to designing quantum machine learning models that operate directly on quantum data.

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Machine Learning Approaches to Decoding Topological Quantum Codes

Decoding is an essential component of quantum error correction (QEC), translating stabilizer measurement outcomes into corrective actions that suppress logical errors and preserve logical quantum information. Building fault-tolerant architectures requires increasing the code distance, which in turn places growing demands on decoding accuracy, scalability, and practical deployability. While a wide range of decoding algorithms have been proposed and demonstrated, achieving reliable, scalable, and real-time decoding remains a significant challenge. Machine-learning (ML) approaches are particularly well suited to this setting, as quantum error decoding is fundamentally a problem of processing large volumes of classical data with complex spatiotemporal correlations. This chapter surveys ML-based methods for quantum error decoding, with a focus on topological codes and an emphasis on architectural principles, practical performance, and real-time considerations. We first frame decoding as a learning problem and outline key paradigms, including discriminative, generative, and reinforcement-learning formulations. We then introduce the neural network building blocks that underpin most contemporary neural decoders and discuss how these components can be integrated to balance expressivity, scalability, and latency. Building on this architectural perspective, we review recent progress and benchmarks in neural decoding for memory experiments, and discuss real-time decoding, open challenges, and future directions toward scalable fault-tolerant quantum computing.

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Structure-Aware Variational State Preparation for Quantum Basket Option Pricing

Basket option pricing often relies on Monte Carlo estimation, for which quantum amplitude estimation (QAE) provides a quadratic speed-up. However, the practical benefit of QAE can be limited by the depth of the state-preparation circuit. We propose a structure-aware quantum state-preparation framework for QAE-based basket option pricing. The framework uses tensor-train (TT) rank information to design shallow variational state-preparation circuits. In the independent regime, TT ranks remove unnecessary entangling links from a hardware-efficient ansatz. In correlated basket settings, we instead prepare asset-wise marginals locally and train a compact latent block to match the basket cumulative distribution function. The Basket-CDF objective targets the basket pushforward distribution rather than the full joint state, directly aligning state preparation with basket-dependent payoffs. Numerical experiments show that the proposed circuits replace the exponential state-preparation depth scaling of exact amplitude loading with linear scaling, while maintaining low-percent basket-pricing errors. Additional sampling-based training experiments and an end-to-end QAE integration study support compatibility with sample-estimated training and standard QAE-based pricing workflows.

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Generative Modeling of Quantum Distribution with Functional Flow Matching

The emergence of powerful deep generative models based on diffusion and flow matching has enabled the learning and modeling of complex distributions. Learning quantum distributions, however, remains challenging due to the inherent difficulty of accurately modeling the meaningful physical properties of quantum states. We propose Quantum Flow Matching (QFM), a novel generative model designed to learn quantum distribution by utilizing spin Wigner function and flow matching. By converting density matrix into the spin Wigner function and leveraging functional flow matching to learn distributions in function space, QFM enables accurate and effective learning of multi-qubit quantum distributions. We demonstrate the effectiveness of our method by evaluating physical quantities such as trace, purity, and entanglement entropy of the generated quantum states, accurately capturing the underlying physics of the given quantum distributions.

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Efficient Simulation of Szegedy Quantum Walk Formulations and Algorithms

Quantum walks provide a versatile framework for quantum algorithms across a wide range of applications. We develop efficient classical simulation methods for Szegedy quantum walks that avoid explicit construction of the full unitary evolution operator. Unlike previous approaches restricted to a particular walk formulation, our framework is built from fundamental update and reflection operators, enabling the simulation of a broader class of Szegedy walk formulations. We further extend these methods to phase-estimation-based algorithms coupled to the walk, including implementations suitable for large sparse graphs. The resulting methods achieve optimal $O(N^2)$ complexity for dense graphs with $N$ nodes. For sparse graphs, the computational cost scales linearly with the number of edges, which is $O(N)$ in many cases. We implement the framework in the Python package SQWLib and illustrate its capabilities through simulations of representative algorithms, including quantum simulated annealing and quantum search on graphs. These results provide a practical tool for studying Szegedy-walk-based algorithms numerically beyond purely analytical treatments.

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Boltzmann Attention: Learnable Ising Couplings for Cooperative Attention

Attention mechanisms are central to modern sequence models, yet standard attention computes relevance primarily through individual query--key similarities. Although softmax normalization introduces competition among positions, a standard attention layer does not explicitly parameterize learnable interactions between attention decisions. This limits its ability to directly model cooperative or antagonistic co-attention structure within the attention mechanism itself. We propose Boltzmann attention, an energy-based generalization in which attention patterns are governed by an interacting Ising model. The method augments the usual data-dependent local fields with learnable pairwise couplings, allowing the model to represent inter-position correlations beyond those captured by softmax or sigmoid attention. Experiments on character-level language modeling and synthetic bracket matching show that Boltzmann attention consistently improves over standard softmax attention within a standard Transformer architecture, with the advantage becoming more pronounced as sequence length increases. A four-way ablation confirms that the improvement arises from the learnable pairwise couplings. These results suggest that explicit inter-position interactions provide a principled enhancement for attention-based sequence modeling. Moreover, the Ising formulation opens a natural path toward quantum-computing-based sampling strategies: we demonstrate that diabatic quantum annealing provides a practical training method while maintaining competitive performance with exact Boltzmann computation.

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Generative Quantum Data Embeddings for Supervised Learning

Many practically relevant applications of quantum machine learning involve classical data, for which performance depends critically on how inputs are embedded into quantum states. Yet the use of a fixed embedding circuit ansatz remains standard practice. We propose an energy-based generative learning framework that synthesizes gate sequences to optimize embedding structures and refine data-tailored parameters, using a fidelity-based surrogate objective to guide the search toward improved class distinguishability. Empirically, the method improves classification performance across diverse settings, while also revealing datasets where architecture search within the present embedding family yields only limited additional gains. We explain this saturation by deriving bounds on the achievable empirical risk in terms of the Wasserstein distance in the input space, showing that classical data geometry provides an \emph{a priori} diagnostic for regimes in which substantial gains from embedding optimization are unlikely. The results establish a practically useful and theoretically motivated framework for searching effective quantum data embeddings through generative optimization, with the attainable gains diagnosed through the geometry of the underlying classical data.

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Multi-Mode Quantum Annealing for Generative Representation Learning with Boltzmann Priors

Energy-based models provide a natural bridge between statistical physics and machine learning by representing data through structured energy landscapes. Boltzmann machines are a particularly compelling class of such models for capturing complex interactions among latent variables, but their use in modern generative learning has been limited by the classical intractability of sampling from general (non-restricted) Boltzmann distributions. Here we develop a quantum-annealing-based framework that enables variational autoencoders with general Boltzmann priors. The framework employs three complementary annealing modes tailored to different stages of learning and deployment: diabatic quantum annealing provides unbiased Boltzmann samples for efficient training, slower annealing concentrates samples near low-energy configurations of the learned prior for unconditional generation, and conditional annealing with external fields steers the learned energy landscape toward attribute-specific regions for conditional generation and semantic editing. Using up to 2000 qubits on a D-Wave Advantage2 processor, we demonstrate stable training and high-quality generation on MNIST, Fashion-MNIST, and CelebA, achieving faster convergence and lower reconstruction loss than a Gaussian-prior VAE with the same encoder-decoder architecture. Beyond generation, the learned energy function provides out-of-distribution detection signals that add discriminative power beyond reconstruction loss. We demonstrate that these scores separate in-distribution samples from held-out digit classes in one-class MNIST experiments and improve the detection of market regime shifts in financial data. These results establish quantum annealing as a practical and controllable physical mechanism for energy-based representation learning and generative modeling beyond the reach of tractable classical approaches.

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Neural Quantum Spectral Operator Learning for Solving Partial Differential Equations

Partial differential equations (PDEs) are central to modeling physical and engineering systems, but repeatedly solving parametric PDEs remains computationally expensive. Operator learning enables fast surrogate inference, yet typically requires large input-output paired datasets generated by costly high-fidelity PDE solvers. Unsupervised operator learning frameworks alleviate data dependency but remain hindered by computational bottlenecks. To address this, we propose Neural Variational Quantum Linear Solver (NVQLS), the first hybrid quantum-classical operator learning framework leveraging the Legendre--Galerkin weak formulation. We critically resolve the sign ambiguity in VQLS energy minimization, preventing erroneous solution representations. Additionally, we introduce a neural embedding, a novel encoding scheme to map varying forcings and PDE coefficients into parameterized quantum circuit representations. These structural innovations provide theoretical computational complexity advantages under efficient state preparation schemes, while achieving superior accuracy compared to a representative classical baseline. Validations on 1D and 2D parametric PDEs under diverse boundary conditions demonstrate NVQLS's capability to simultaneously process varying inputs, offering a scalable unsupervised approach to quantum-enhanced operator learning.

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Finite Imaginary-Time Evolution for Polynomial Unconstrained Binary Optimization

Imaginary-time evolution is a standard primitive for ground-state preparation but is nonunitary, precluding direct quantum implementation. We develop Finite Imaginary-Time Evolution (FinITE), a finite-beta construction for diagonal Pauli-Z cost Hamiltonians arising from polynomial unconstrained binary optimization (PUBO) instances, including QUBO and HUBO cases. FinITE uses the linear-combination-of-unitaries (LCU) framework to implement a scaled imaginary-time propagator. The commuting Pauli-Z structure makes termwise block-encodings compose without product-formula error, and higher-order Pauli-Z terms are handled directly without quadratization. The structure yields an exact finite-beta identity between the LCU success probability and the ground-subspace fidelity. Combined with a gap-based fidelity lower bound, the identity yields a closed-form sufficient imaginary-time threshold beta-star for a chosen target fidelity. The threshold depends on estimates of the spectral gap and the initial ground-subspace overlap. Because the LCU success event is flagged by a known ancilla outcome, we integrate fixed-point amplitude amplification with an explicit query-complexity bound. Statevector simulations verify the identity on a five-vertex MaxCut (QUBO) and an eight-qubit cubic HUBO instance, and shot-based simulations on the MaxCut instance illustrate the predicted finite-beta threshold and amplification procedure.

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Neural quantum support vector data description for one-class classification

One-class classification (OCC) is a fundamental problem in machine learning with numerous applications, such as anomaly detection and quality control. With the increasing complexity and dimensionality of modern datasets, there is a growing demand for advanced OCC techniques with better expressivity and efficiency. We introduce Neural Quantum Support Vector Data Description (NQSVDD), a classical-quantum hybrid framework for OCC that performs end-to-end optimized hierarchical representation learning. NQSVDD integrates a classical neural network with trainable quantum data encoding and a variational quantum circuit, enabling the model to learn nonlinear feature transformations tailored to the OCC objective. The hybrid architecture maps input data into an intermediate high-dimensional feature space and subsequently projects it into a compact latent space defined through quantum measurements. Importantly, both the feature embedding and the latent representation are jointly optimized such that normal data form a compact cluster, for which a minimum-volume enclosing hypersphere provides an effective decision boundary. Experimental evaluations on benchmark datasets demonstrate that NQSVDD achieves competitive or superior AUC performance compared to classical Deep SVDD and quantum baselines, while maintaining parameter efficiency and robustness under realistic noise conditions.

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Noise-adaptive hybrid quantum convolutional neural networks based on depth-stratified feature extraction

Hierarchical quantum classifiers, such as quantum convolutional neural networks (QCNNs), represent recent progress toward designing effective and feasible architectures for quantum classification. However, their performance on near-term quantum hardware remains highly sensitive to noise accumulation across circuit depth, calling for strategies beyond circuit-architecture design alone. We propose a noise-adaptive hybrid QCNN that improves classification under noise by exploiting depth-stratified intermediate measurements. Instead of discarding qubits removed during pooling operations, we measure them and use the resulting outcomes as classical features that are jointly processed by a classical neural network. This hybrid hierarchical design enables noise-adaptive inference by integrating quantum intermediate measurements with classical post-processing. Systematic experiments across multiple circuit sizes and noise settings, including hardware-calibrated noise models derived from IBM Quantum backend data, demonstrate more stable convergence, reduced loss variability, and consistently higher classification accuracy compared with standard QCNNs. Moreover, we observe that this performance advantage significantly amplifies as the circuit size increases, confirming that the hybrid architecture mitigates the scaling limitations of standard architectures. Notably, the multi-basis measurement variant attains performance close to the noiseless limit even under realistic noise. While demonstrated for QCNNs, the proposed depth-stratified feature extraction applies more broadly to hierarchical quantum classifiers that progressively discard qubits.

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Improving Generalization and Trainability of Quantum Eigensolvers via Graph Neural Encoding

Determining the ground state of a many-body Hamiltonian is a central problem across physics, chemistry, and combinatorial optimization, yet it is often classically intractable due to the exponential growth of Hilbert space with system size. Even on fault-tolerant quantum computers, quantum algorithms with convergence guarantees -- such as quantum phase estimation and quantum subspace methods -- require an initial state with sufficiently large overlap with the true ground state to be effective. Variational quantum eigensolvers (VQEs) are natural candidates for preparing such states; however, standard VQEs typically exhibit poor generalization, requiring retraining for each Hamiltonian instance, and often suffer from barren plateaus, where gradients can vanish exponentially with circuit depth and system size. To address these limitations, we propose an end-to-end representation learning framework that combines a graph autoencoder with a classical neural network to generate VQE parameters that generalize across Hamiltonian instances. By encoding interaction topology and coupling structure, the proposed model produces high-overlap initial states without instance-specific optimization. Through extensive numerical experiments on families of one- and two-local Hamiltonians, we demonstrate improved generalization and trainability, manifested as reduced test error and a significantly milder decay of gradient variance. We further show that our method substantially accelerates convergence in quantum subspace-based eigensolvers, highlighting its practical impact for downstream quantum algorithms.

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Generative Krylov Subspace Representations for Scalable Quantum Eigensolvers

Predicting ground state energies of quantum many-body systems is one of the central computational challenges in quantum chemistry, physics, and materials science. Krylov subspace methods, such as Krylov Quantum Diagonalization and Sample-based Krylov Quantum Diagonalization, are promising approaches for this task on near-term quantum computers. However, both require repeated quantum circuit executions for each Krylov subspace and for every new Hamiltonian, posing a major bottleneck under noisy hardware constraints. We introduce Generative Krylov Subspace Representations (GenKSR), a framework that learns a classical generative representation of the entire Krylov diagonalization process. To enable effective modeling of quantum systems, GenKSR leverages a conditional generative model framework. We investigate two representative backbone architectures, the standard Transformer and the Mamba state-space model. By learning the distribution of measurement outcomes conditioned on Hamiltonian parameters and evolution time, GenKSR generates Krylov subspace samples for unseen Hamiltonians and for larger subspace dimensions than those used in training. This enables full energy reconstruction purely from the classical model, without additional quantum experiments. We validate our approach through simulations of 15-qubit 1D and 16-qubit 2D Heisenberg models, as well as a hardware experiment on a 20-qubit XXZ chain executed on an IBM quantum processor. Our model successfully learns the distribution from experimental data and generates a high-fidelity representation of the quantum process. This representation enables classical reproduction of experimental outcomes, supports reliable energy estimates for unseen Hamiltonians, and significantly reduces the need for further quantum computation.

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Diabatic quantum annealing for training energy-based generative models

Energy-based generative models, such as restricted Boltzmann machines (RBMs), require unbiased Boltzmann samples for effective training. Classical Markov chain Monte Carlo methods, however, converge slowly and yield correlated samples, making large-scale training difficult. We address this bottleneck by applying the analytic relation between annealing schedules and effective inverse temperature in diabatic quantum annealing. By implementing this prescription on a quantum annealer, we obtain temperature-controlled Boltzmann samples that enable RBM training with faster convergence and lower validation error than classical sampling. We further identify a systematic temperature misalignment intrinsic to analog quantum computers and propose an analytical rescaling method that mitigates this hardware noise, thereby enhancing the practicality of quantum annealers as Boltzmann samplers. In our method, the model's connectivity is set directly by the qubit connectivity, transforming the computational complexity inherent in classical sampling into a requirement on quantum hardware. This shift allows the approach to extend naturally from RBMs to fully connected Boltzmann machines, opening opportunities inaccessible to classical training methods.

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Optimizing Quantum Data Embeddings for Ligand-Based Virtual Screening

Effective molecular representations are essential for ligand-based virtual screening. We investigate how quantum data embedding strategies can improve this task by developing and evaluating a family of quantum-classical hybrid embedding approaches. These approaches combine classical neural networks with parameterized quantum circuits in different ways to generate expressive molecular representations and are assessed across two benchmark datasets of different sizes: the LIT-PCBA and COVID-19 collections. Across multiple biological targets and class-imbalance settings, several quantum and hybrid embedding variants consistently outperform classical baselines, especially in limited-data regimes. These results highlight the potential of optimized quantum data embeddings as data-efficient tools for ligand-based virtual screening.

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Measurement-based Dynamical Decoupling for Fidelity Preservation on Large-scale Quantum Processors

Dynamical decoupling (DD) is a key technique for suppressing decoherence and preserving the performance of quantum algorithms. We introduce a measurement-based DD (MDD) protocol that determines control unitary gates from partial measurements of noisy subsystems, with measurement overhead scaling linearly with the number of subsystems. We prove that, under local energy relaxation and dephasing noise, MDD achieves the maximum entanglement fidelity attainable by any DD scheme based on bang-bang operations to first order in evolution time. On the IBM Eagle processor, MDD achieved up to a $450$-fold improvement in the success probability of a $14$-qubit quantum Fourier transform, and improved the accuracy of ground-state energy estimation for $N_2$ in the $56$-qubit sample-based quantum diagonalization compared with the standard XX-pulse DD. These results establish MDD as a scalable and effective approach for suppressing decoherence in large-scale quantum algorithms.

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Scalable Neural Decoders for Practical Real-Time Quantum Error Correction

Real-time, scalable, and accurate decoding is a critical component for realizing a fault-tolerant quantum computer. While Transformer-based neural decoders such as \textit{AlphaQubit} have demonstrated high accuracy, the computational complexity of their core attention mechanism, which scales as $\mathcal{O}(d^4)$ with code distance $d$, results in decoding speeds insufficient for practical real-time applications. In this work, we introduce and evaluate a \textit{Mamba}-based decoder, a state-space model with $\mathcal{O}(d^2)$ complexity. In memory experiments using Sycamore hardware data, our Mamba decoder matches the performance of its Transformer-based counterpart, providing that its superior efficiency does not come at the cost of performance. Crucially, in simulated real-time scenarios that account for decoder-induced noise, the Mamba decoder significantly outperforms the Transformer, exhibiting a higher error threshold of $0.0104$ compared to $0.0097$. These results demonstrate that Mamba decoders offer a compelling balance between speed and accuracy, making them a promising architecture for scalable, real-time quantum error correction.

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