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Mostafa Atallah

Publications and source records attributed to Mostafa Atallah.

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Predicting Resource Efficient Hamiltonian Decomposition for Continuous-Time Quantum Walk Simulations

Simulating a continuous-time quantum walk (CTQW) on a graph in the circuit model of quantum computing requires decomposing its Hamiltonian into terms that can be Trotterized into hardware-native gates. We consider two such decompositions: the standard Pauli decomposition and the recently introduced matching decomposition. Prior work suggests that the matching decomposition uses fewer CX gates on sparse graphs, while the Pauli decomposition uses fewer on denser graphs. Since CX gates dominate error and runtime on current hardware, we train machine learning models to predict, for a given graph, which of the two decompositions produces the smaller CX gate count. We train and evaluate on the complete population of all 11,117 connected eight-vertex graphs from Brendan McKay's database, so the class balance and overlap are measured directly rather than estimated. We use twelve features: ten topological properties of the graph and two that count the terms the Pauli and matching decompositions produce (n_Pauli and n_match), both computable without transpiling the simulation circuit. Standard topological properties alone provide little predictive power. Instead, the dominant signal comes from n_Pauli, a property of the Hamiltonian decomposition rather than an intrinsic property of the graph; degree variance is the only other feature that carries signal. Across a range of models the Matthews correlation coefficient (MCC) falls in a narrow band, from 0.569 untuned to 0.593 after tuning, so no single architecture stands out. We adopt a single-hidden-layer neural network at MCC 0.593. Applied frozen to a held-out, class-balanced test set of larger graphs (up to 256 vertices) from structured and Erdos-Renyi families, the model transfers, with MCC rising from 0.785 at N=8 to 1 at N>=64.

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Layer-wise QUBO-Based Training of CNN Classifiers for Quantum Annealing

Variational quantum circuits for image classification suffer from barren plateaus, while quantum kernel methods scale quadratically with dataset size. We propose an iterative framework based on Quadratic Unconstrained Binary Optimization (QUBO) for training the classifier head of convolutional neural networks (CNNs) via quantum annealing, entirely avoiding gradient-based circuit optimization. Following the Extreme Learning Machine paradigm, convolutional filters are randomly initialized and frozen, and only the fully connected layer is optimized. At each iteration, a convex quadratic surrogate derived from the feature Gram matrix replaces the non-quadratic cross-entropy loss, yielding an iteration-stable curvature proxy. A per-output decomposition splits the $C$-class problem into $C$ independent QUBOs, each with $(d+1)K$ binary variables, where $d$ is the feature dimension and $K$ is the bit precision, so that problem size depends on the image resolution and bit precision, not on the number of training samples. We evaluate the method on six image-classification benchmarks (sklearn digits, MNIST, Fashion-MNIST, CIFAR-10, EMNIST, KMNIST). A precision study shows that accuracy improves monotonically with bit resolution, with 10 bits representing a practical minimum for effective optimization; the 15-bit formulation remains within the qubit and coupler limits of current D-Wave Advantage hardware. The 20-bit formulation matches or exceeds classical stochastic gradient descent on MNIST, Fashion-MNIST, and EMNIST, while remaining competitive on CIFAR-10 and KMNIST. All experiments use simulated annealing, establishing a baseline for direct deployment on quantum annealing hardware.

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A matching decomposition algorithm for simulating quantum walk Hamiltonians

In this work, we present a new algorithm for generating quantum circuits that efficiently implement continuous time quantum walks on arbitrary simple sparse graphs. The algorithm, called matching decomposition, works by decomposing a continuous-time quantum walk Hamiltonian into a collection of exactly implementable Hamiltonians corresponding to matchings in the underlying graph followed by a novel graph compression algorithm that merges edges in the graph. We develop a greedy matching heuristic and a compression-aware matching heuristic, both of which can be used in the quantum circuit algorithm. Lastly, we convert the walks to a circuit and Trotterize over these components. The dynamics of the walker on each edge in the matching can be implemented in the circuit model as sequences of CX and CRx gates. We do not use Pauli decomposition when implementing walks along each matching. Furthermore, we compare greedy (compression-aware) matching decomposition to a standard Pauli-based simulation pipeline and find that greedy (compression-aware) matching decomposition consistently yields substantial resource reductions, requiring up to 43$\%$ (70\%) fewer controlled gates and up to 54$\%$ (75\%) shallower circuits than Pauli decomposition across multiple graph families. Finally, we also present examples and theoretical results for when matching decomposition can exactly simulate a continuous-time quantum walk on a graph.

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Investigating Different Barren Plateaus Mitigation Strategies in Variational Quantum Eigensolver

Variational Quantum Eigensolver (VQE) algorithms suffer from barren plateaus, where gradients vanish with system size and circuit depth. Although many mitigation strategies exist, their connection to convergence performance under different iteration budgets remains unclear. Moreover, a systematic analysis identifying which state-of-the-art mitigation techniques perform best under specific scenarios is also lacking. We benchmark four approaches, Local-Global, Adiabatic, State Efficient Ansatz (SEA), and Pretrained VQE, against standard VQE on molecular systems from 4 to 14 qubits, analyzing gradient variance up to 50 layers and convergence over 1000 iterations. Our results show that the impact of gradient preservation is iteration-dependent. In the 14-qubit BeH2 system, Pretrained VQE outperforms SEA at 100 iterations despite lower gradient variance, but SEA becomes 2.2x more accurate at 1000 iterations. For smaller systems, SEA achieves near-exact energies (H2: 10^-5 Ha, LiH: 2x10^-4 Ha) with fidelities 0.999, while standard methods plateau early. The results demonstrate that robust barren plateau mitigation depends on aligning the chosen strategy with both system size and available computational budget, rather than treating gradient variance as the sole predictor of performance.

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Efficient circuits for leaf-separable state preparation

Efficient state preparation is a challenging and important problem in quantum computing. In this work, we present a recursive state preparation algorithm that combines logarithmic-depth Dicke state circuits with Hamming weight encoders for efficiently preparing ``leaf-separable" quantum states. The algorithm is built on binary partition trees, generalized weight distribution blocks (gWDBs), and leaf-level encoders. We evaluate the performance of the algorithm by numerically simulating it on randomly generated target states with between 4 and 15 qubits. Compared to general state preparation approaches which require $O(2^n)$ CX gates, our algorithm achieves a circuit depth of $O(k\log\frac{n}{k} + 2^k)$ and uses $O(n(k+2^k))$ two-qubit gates, where $k < n$ denotes the subtree size. We also compare implementations of the algorithm with and without the use of ancilla qubits, providing a detailed analysis of the trade-offs in circuit depth and two-qubit gate counts. These results contribute to scalable state preparation for quantum algorithms that require structured inputs such as Dicke or near-Dicke states.

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An Exclusive-Sum-of-Products Pipeline for QAOA

The quantum approximate optimization algorithm is commonly used to solve combinatorial optimization problems. While unconstrained problems map naturally into the algorithm, incorporating constraints typically requires penalizing constraint violations in the objective function. In this work, we propose an alternative approach that encodes constraints as Boolean expressions in exclusive-sum-of-products (ESOP) form before penalization. We test this method on the maximum independent set problem using graphs with 3 to 20 vertices and find that ESOP constraint formulations achieve higher approximation ratios than standard constraint penalization methods, with percent increases of up to 30.3%. Furthermore, ESOP constraint formulations result in higher approximation ratios than standard QAOA penalization approaches after one layer of the algorithm on approximately 64% of the tested graphs.

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A mixed-integer program for circuit execution time minimization with precedence constraints

We present a mixed-integer programming (MIP) model for scheduling quantum circuits to minimize execution time. Our approach maximizes parallelism by allowing non-overlapping gates (those acting on distinct qubits) to execute simultaneously. Our methods apply to general circuits with precedence constraints. First, we derive closed-formulas for the execution time of circuits generated by ma-QAOA on star graphs for a layered, greedy, and MIP schedules. We then compare the MIP schedule against layered and greedy scheduling approaches on the circuits generated by ma-QAOA for solving the MaxCut problem on all non-isomorphic connected graphs with 3-7 vertices. These experiments demonstrate that the MIP scheduler consistently results in shorter circuit execution times than greedy and layered approaches, with up to 24\% savings.

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Integer Factorization through Func-QAOA

Integer factorization is a significant problem, with implications for the security of widely-used cryptographic schemes. No efficient classical algorithm for polynomial-time integer factorization has been found despite extensive research. Although Peter Shor's breakthrough quantum algorithm offers a viable solution, current limitations of noisy intermediate-scale quantum (NISQ) computers hinder its practical implementation. To address this, researchers have explored alternative methods for factorization suitable for NISQ devices. One such method is the Quantum Approximate Optimization Algorithm, which treats factoring as an optimization problem defined over binary bits, resulting in various problematic aspects. In this paper, we explore the Func-QAOA approach for factorization, which premises overcoming some of the limitations of previous approaches and allows the incorporation of more advanced factorization techniques. After reviewing the most promising quantum implementations for integer arithmetics, we present a few illustrative examples to demonstrate the efficacy of the Func-QAOA approach and discuss methods to reduce the search space to speed up the optimization process.

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