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Electronic structure simulation is an anticipated application for quantum computers. Due to high-dimensional quantum entanglement in strongly correlated systems, the quantum resources required to perform such simulations are far beyond the…

Quantum Physics · Physics 2022-01-25 Jie Liu , Zhenyu Li , Jinlong Yang

Efficient quantum circuit optimization schemes are central to quantum simulation of strongly interacting quantum many body systems. Here, we present an optimization algorithm which combines machine learning techniques and tensor network…

Quantum Physics · Physics 2024-08-23 David Rogerson , Ananda Roy

We derive a basis for the vector space of bounded operators acting on a $d$-dimensional system Hilbert space $C^d$. In the context of quantum computation the basis elements are identified as the generalised Pauli matrices - the error…

Quantum Physics · Physics 2008-11-14 Colin Wilmott , Peter Wild

The simulation of chemistry is among the most promising applications of quantum computing. However, most prior work exploring algorithms for block-encoding, time-evolving, and sampling in the eigenbasis of electronic structure Hamiltonians…

We present an effective operator formalism for open quantum systems. Employing perturbation theory and adiabatic elimination of excited states for a weakly driven system, we derive an effective master equation which reduces the evolution to…

Quantum Physics · Physics 2012-07-03 Florentin Reiter , Anders S. Sørensen

I describe a simple algorithm for numerically finding the ground state and low-lying excited states of a quantum system. The algorithm is an adaptation of the relaxation method for solving Poisson's equation, and is fundamentally based on…

Computational Physics · Physics 2017-09-13 Daniel V. Schroeder

This paper presents a quantum algorithm for solving the fractional Poisson equation \((-\Delta)^s u = f\) with \(s \in (0,1)\) on bounded domains. The proposed approach combines rational approximation techniques with quantum linear system…

Quantum Physics · Physics 2026-04-02 Yin Yang , Yue Yu , Long Zhang , Ming Zhou

In many problems in Computational Physics and Chemistry, one finds a special kind of sparse matrices, termed "banded matrices". These matrices, which are defined as having non-zero entries only within a given distance from the main…

Computational Physics · Physics 2013-06-21 Pablo García-Risueño , Pablo Echenique

Systems of linear equations are used to model a wide array of problems in all fields of science and engineering. Recently, it has been shown that quantum computers could solve linear systems exponentially faster than classical computers,…

Harnessing the full power of nascent quantum processors requires the efficient management of a limited number of quantum bits with finite lifetime. Hybrid algorithms leveraging classical resources have demonstrated promising initial results…

We present a theoretical result, which is based on the linear algebra theory (similar operators). The obtained theoretical results optimize the experimental technique to construct quantum computer e.g., reduces the number of steps to…

Quantum Physics · Physics 2007-05-23 Z. S. Sazonova , Ranjit Singh

A scheme for globally addressing a quantum computer is presented along with its realisation in an optical lattice setup of one, two or three dimensions. The required resources are mainly those necessary for performing quantum simulations of…

Quantum Physics · Physics 2015-06-26 Alastair Kay , Jiannis K. Pachos

We propose a Hamiltonian-based quantum state preparation method implemented via a shallow parametrized quantum circuit. The approach learns the parameters of a diagonal Hamiltonian through a classical training phase, while the quantum…

We describe quantum circuits with only $\widetilde{\cal O}(N)$ Toffoli complexity that block encode the spectra of quantum chemistry Hamiltonians in a basis of $N$ arbitrary (e.g., molecular) orbitals. With ${\cal O}(\lambda / \epsilon)$…

Unitary and non-unitary diagonal operators are fundamental building blocks in quantum algorithms with applications in the resolution of partial differential equations, Hamiltonian simulations, the loading of classical data on quantum…

Quantum Physics · Physics 2025-01-22 Julien Zylberman , Ugo Nzongani , Andrea Simonetto , Fabrice Debbasch

Optimization problems are prevalent in various fields, and the gradient-based gradient descent algorithm is a widely adopted optimization method. However, in classical computing, computing the numerical gradient for a function with $d$…

Quantum Physics · Physics 2023-05-12 Ronghang Chen , Shi-Yao Hou , Cong Guo , Guanru Feng

We introduce Unitaria, a Python library that brings the simplicity of classical linear algebra toolkits such as NumPy and SciPy to the implementation of quantum algorithms based on block encodings, a general-purpose abstraction in which a…

Quantum Physics · Physics 2026-05-12 Matthias Deiml , Oliver Hüttenhofer , Ram Mosco , Jakob S. Kottmann , Daniel Peterseim

We develop theoretical methods for the implementation of creation and destruction operators in separate registers of a quantum computer, allowing for a transparent and dynamical creation and destruction of particle modes in second…

High Energy Physics - Theory · Physics 2024-06-12 Juan José Gálvez-Viruet , Felipe J. Llanes-Estrada

In optimization, one of the well-known classical algorithms is power iterations. Simply stated, the algorithm recovers the dominant eigenvector of some diagonalizable matrix. Since numerous optimization problems can be formulated as an…

Quantum Physics · Physics 2024-04-24 V. Akshay , Ar. Melnikov , A. Termanova , M. R. Perelshtein

We propose a novel quantum algorithm for solving linear autonomous ordinary differential equations (ODEs) using the Pad\'e approximation. For linear autonomous ODEs, the discretized solution can be represented by a product of matrix…

Quantum Physics · Physics 2025-06-18 Dekuan Dong , Yingzhou Li , Jungong Xue
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