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QAOA is a hybrid quantum-classical algorithm to solve optimization problems in gate-based quantum computers. It is based on a variational quantum circuit that can be interpreted as a discretization of the annealing process that quantum…

Quantum Physics · Physics 2025-05-28 Francisco Chicano , Zakaria Abdelmoiz Dahi , Gabriel Luque

The computation of generalized inverses of quaternion matrices is a fundamental problem in quaternion linear algebra, with wide-ranging applications in signal processing, image restoration, and multidimensional data analysis. This paper…

Numerical Analysis · Mathematics 2026-05-05 Biswarup Karmakar , Neha Bhadala , Ratikanta Behera

Quantum Genetic Algorithms (QGAs) are an emerging field of multivariate quantum optimization that emulate Darwinian evolution and natural selection, with vast applications in chemistry and engineering. The appropriate application of fitness…

Quantum Physics · Physics 2025-12-24 Dennis Lima , Rakesh Saini , Saif Al-Kuwari

Integer programming (IP) is an NP-hard combinatorial optimization problem that is widely used to represent a diverse set of real-world problems spanning multiple fields, such as finance, engineering, logistics, and operations research. It…

Quantum Physics · Physics 2025-08-20 Kapil Goswami , Peter Schmelcher , Rick Mukherjee

In this work, we perform Bayesian inference tasks for the chemical master equation in the tensor-train format. The tensor-train approximation has been proven to be very efficient in representing high dimensional data arising from the…

Permutationally invariant polynomial (PIP) regression has been used to obtain machine-learned (ML) potential energy surfaces, including analytical gradients, for many molecules and chemical reactions. Recently, the approach has been…

Chemical Physics · Physics 2024-07-30 Paul L. Houston , Chen Qu , Apurba Nandi , Riccardo Conte , Qi Yu , Joel M. Bowman

Understanding how molecules arrange on surfaces is fundamental to surface chemistry and essential for the rational design of catalytic and functional materials. In particular, the energetically most stable configuration provides valuable…

Chemical Physics · Physics 2025-07-29 Tuan Minh Do , Tomoya Shiota , Wataru Mizukami

Optimization problems in disciplines such as machine learning are commonly solved with iterative methods. Gradient descent algorithms find local minima by moving along the direction of steepest descent while Newton's method takes into…

Quantum Physics · Physics 2018-08-20 Patrick Rebentrost , Maria Schuld , Leonard Wossnig , Francesco Petruccione , Seth Lloyd

Quantized tensor trains (QTTs) are a multiscale computational framework that can potentially reduce the computational cost of solving partial differential equations and initial value problems by making low-rank approximations. However, its…

Computational Physics · Physics 2026-05-14 Erika Ye

Quantum technologies are developing powerful tools to generate and manipulate coherent superpositions of different energy levels. Envisaging a new generation of energy-efficient quantum devices, here we explore how coherence can be…

Quantum Physics · Physics 2017-09-06 Giulio Chiribella , Yuxiang Yang

This work presents a novel method for task optimization in industrial plants using quantum-inspired tensor network technology. This method obtains the best possible combination of tasks on a set of machines with directed constraints while…

The optimization of atomic structures plays a pivotal role in understanding and designing materials with desired properties. However, conventional computational methods often struggle with the formidable task of navigating the vast…

Materials Science · Physics 2024-11-19 Peder Lyngby , Casper Larsen , Karsten Wedel Jacobsen

We give a probabilistic analysis of the unit-demand Euclidean capacitated vehicle routing problem in the random setting, where the input distribution consists of $n$ unit-demand customers modeled as independent, identically distributed…

Data Structures and Algorithms · Computer Science 2021-12-14 Claire Mathieu , Hang Zhou

We introduce a novel heuristic global optimization method, energy landscape paving (ELP), which combines core ideas from energy surface deformation and tabu search. In appropriate limits, ELP reduces to existing techniques. The approach is…

Computational Physics · Physics 2009-11-07 Luc T. Wille , U. H. E. Hansmann

The Quantum Approximate Optimisation Algorithm (QAOA) is a widely studied quantum-classical iterative heuristic for combinatorial optimisation. While QAOA targets problems in complexity class NP, the classical optimisation procedure…

Quantum Physics · Physics 2025-11-12 Tom Krüger , Wolfgang Mauerer

Protein folding -- the problem of predicting the spatial structure of a protein given its sequence of amino-acids -- has attracted considerable research effort in biochemistry in recent decades. In this work, we explore the potential of…

Quantum Physics · Physics 2022-04-06 Sami Boulebnane , Xavier Lucas , Agnes Meyder , Stanislaw Adaszewski , Ashley Montanaro

We propose a unifying framework for the state preparation using quantum power method algorithms based on generalized quantum signal processing (GQSP). We apply GQSP to realize quantum analogs of classical power iteration, power Lanczos,…

Quantum Physics · Physics 2025-12-10 Viktor Khinevich , Yasunori Lee , Nobuyuki Yoshioka , Wataru Mizukami

Recent demonstrations on specialized benchmarks have reignited excitement for quantum computers, yet whether they can deliver an advantage for practical real-world problems remains an open question. Here, we show that probabilistic…

Fixed-point iteration algorithms like RTA (response time analysis) and QPA (quick processor-demand analysis) are arguably the most popular ways of solving schedulability problems for preemptive uniprocessor FP (fixed-priority) and EDF…

Operating Systems · Computer Science 2023-08-21 Abhishek Singh

In the noisy intermediate-scale quantum era, emerging classical-quantum hybrid optimization algorithms, such as variational quantum algorithms (VQAs), can leverage the unique characteristics of quantum devices to accelerate computations…