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Quantum circuits are typically represented by a (ordered) sequence of gates over a set of virtual qubits. During compilation, the virtual qubits of the gates are assigned to the physical qubits of the underlying quantum hardware, a step…

We introduce QuantumGEP, a scientific computer program that uses gene expression programming (GEP) to find a quantum circuit that either (i) maps a given set of input states to a given set of output states, or (ii) transforms a fixed…

Quantum Physics · Physics 2023-03-16 Gonzalo Alvarez , Ryan Bennink , Stephan Irle , Jacek Jakowski

We introduce a family of variational quantum algorithms called quantum iterative power algorithms (QIPA) that outperform existing hybrid near-term quantum algorithms of the same kind. We demonstrate the capabilities of QIPA as applied to…

One of the most important topics in quantum scientific computing is solving differential equations. In this paper, generalized quantum functional expansion (QFE) framework is proposed. In the QFE framework, a functional expansion of…

Quantum Physics · Physics 2024-09-30 Jinhwan Sul , Yan Wang

The variational quantum eigensolver (VQE) is a hybrid quantum-classical algorithm designed for current and near-term quantum devices. Despite its initial success, there is a lack of understanding involving several of its key aspects. There…

Quantum Physics · Physics 2023-03-22 Manpreet Singh Jattana , Fengping Jin , Hans De Raedt , Kristel Michielsen

One of the significant breakthroughs in quantum computation is Grover's algorithm for unsorted database search. Recently, the applications of Grover's algorithm to solve global optimization problems have been demonstrated, where unknown…

Quantum Physics · Physics 2017-11-22 Yan Wang

Quantum computing has the potential to improve our ability to solve certain optimization problems that are computationally difficult for classical computers, by offering new algorithmic approaches that may provide speedups under specific…

Quantum Physics · Physics 2025-04-24 Ilya Tyagin , Marwa H. Farag , Kyle Sherbert , Karunya Shirali , Yuri Alexeev , Ilya Safro

Parametrized quantum optical circuits are a class of quantum circuits in which the carriers of quantum information are photons and the gates are optical transformations. Classically optimizing these circuits is challenging due to the…

Quantum Physics · Physics 2020-12-02 Filippo M. Miatto , Nicolás Quesada

The finite element method (FEM) has several computational steps to numerically solve a particular problem, to which many efforts have been directed to accelerate the solution stage of the linear system of equations. However, the finite…

Numerical Analysis · Computer Science 2015-01-21 Francisco Javier Ramírez-Gil , Marcos de Sales Guerra Tsuzuki , Wilfredo Montealegre-Rubio

Variational quantum algorithms (VQAs) are a modern family of quantum algorithms designed to solve optimization problems using a quantum computer. Typically VQAs rely on a feedback loop between the quantum device and a classical optimization…

Quantum Physics · Physics 2022-08-26 Alexey Uvarov

The expectation-maximization (EM) algorithm is an iterative method for finding maximum likelihood estimates when data are incomplete or are treated as being incomplete. The EM algorithm and its variants are commonly used for parameter…

Computation · Statistics 2013-06-26 Ryan P. Browne , Sanjeena Subedi , Paul McNicholas

Accurately and efficiently predicting the equilibrium geometries of large molecules remains a central challenge in quantum computational chemistry, even with hybrid quantum-classical algorithms. Two major obstacles hinder progress: the…

Quantum Physics · Physics 2026-04-07 Yajie Hao , Qiming Ding , Xiaoting Wang , Xiao Yuan

In this work, we study Bayesian quantum parameter estimation given a finite number of uses of the process encoding one or more unknown physical quantities. For multiple uses, it is conventional to classify quantum metrological protocols as…

Quantum Physics · Physics 2026-02-11 Erik L. André , Jessica Bavaresco , Mohammad Mehboudi

We present a novel method for improving the quantum simulation of the ground state energy of molecules. We perform a pre-processing step classically, which reduces the dimensionality of the problem by generating a custom mapping which…

Quantum Physics · Physics 2023-03-03 Kaur Kristjuhan , Mark Nicholas Jones

With gates of a quantum computer designed to encode multi-dimensional vectors, projections of quantum computer states onto specific qubit states can produce kernels of reproducing kernel Hilbert spaces. We show that quantum kernels obtained…

Quantum Physics · Physics 2024-06-19 Jun Dai , Roman V. Krems

Optimally hybrid numerical solvers were constructed for massively parallel generalized eigenvalue problem (GEP).The strong scaling benchmark was carried out on the K computer and other supercomputers for electronic structure calculation…

Computational Physics · Physics 2016-02-10 Hiroto Imachi , Takeo Hoshi

Block encoding is a key ingredient in the recently developed quantum singular value transformation (QSVT) framework, which provides a unifying description for many quantum algorithms. Initially introduced to simplify and optimize resource…

Quantum Physics · Physics 2025-04-01 Nhat A. Nghiem , Tzu-Chieh Wei

Current algorithms for large-scale industrial optimization problems typically face a trade-off: they either require exponential time to reach optimal solutions, or employ problem-specific heuristics. To overcome these limitations, we…

Quantum Physics · Physics 2025-10-16 Matteo Vandelli , Francesco Ferrari , Daniele Dragoni

Obtaining high-precision guaranteed lower eigenvalue bounds remains difficult, even though the standard high-order conforming finite element (FEM) easily yields extremely sharp upper bounds. Recently developed rigorous approaches using such…

Numerical Analysis · Mathematics 2025-12-30 Xuefeng Liu , Michael Plum

The variational quantum eigensolver (or VQE) uses the variational principle to compute the ground state energy of a Hamiltonian, a problem that is central to quantum chemistry and condensed matter physics. Conventional computing methods are…

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