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The present paper gives a review of our recent progress and latest results for novel linear-algebraic algorithms and its application to large-scale quantum material simulations or electronic structure calculations. The algorithms are…

As compute power increases with time, more involved and larger simulations become possible. However, it gets increasingly difficult to efficiently use the provided computational resources. Especially in particle-based simulations with a…

Distributed, Parallel, and Cluster Computing · Computer Science 2019-08-05 Sebastian Eibl , Ulrich Rüde

We study how parallelism can speed up quantum simulation. A parallel quantum algorithm is proposed for simulating the dynamics of a large class of Hamiltonians with good sparse structures, called uniform-structured Hamiltonians, including…

Quantum Physics · Physics 2024-01-17 Zhicheng Zhang , Qisheng Wang , Mingsheng Ying

We develop randomized quantum algorithms to simulate quantum collision models, also known as repeated interaction schemes, which provide a rich framework to model various open-system dynamics. The underlying technique involves composing…

Quantum Physics · Physics 2025-08-20 Kushagra Garg , Zeeshan Ahmed , Subhadip Mitra , Shantanav Chakraborty

Micro-macro models provide a powerful tool to study the relationship between microscale mechanisms and emergent macroscopic behavior. However, the detailed microscopic modeling may require tracking and evolving a high-dimensional…

Computational Physics · Physics 2019-08-13 Steven Cook , Tamar Shinar

Particle tracking in large-scale numerical simulations of turbulent flows presents one of the major bottlenecks in parallel performance and scaling efficiency. Here, we describe a particle tracking algorithm for large-scale parallel…

Fluid Dynamics · Physics 2022-05-31 Cristian C. Lalescu , Bérenger Bramas , Markus Rampp , Michael Wilczek

Understanding the complexity of quantum many-body systems has been attracting much attention recently for its fundamental importance in characterizing complex quantum phases beyond the scope of quantum entanglement. Here, we investigate…

Quantum Physics · Physics 2025-07-31 Wei Xia , Yijia Zhou , Xingze Qiu , Xiaopeng Li

Recent years have witnessed an unprecedented increase in experiments and hybrid simulations involving quantum computers. In particular, quantum annealers. Although quantum supremacy has not been established thus far, there exist a plethora…

Quantum Physics · Physics 2019-12-10 Konrad Jałowiecki , Andrzej Więckowski , Piotr Gawron , Bartłomiej Gardas

The interplay of quantum and classical simulation and the delicate divide between them is in the focus of massively parallelized tensor network state (TNS) algorithms designed for high performance computing (HPC). In this contribution, we…

Quantum Physics · Physics 2023-05-10 Andor Menczer , Örs Legeza

This work develops a symplectic framework for quantum computing to be applied to classical Hamiltonian systems, exploiting the intrinsic geometric compatibility between unitary quantum evolution and symplectic phase-space dynamics in a…

For decades, people are developing efficient numerical methods for solving the challenging quantum many-body problem, whose Hilbert space grows exponentially with the size of the problem. However, this journey is far from over, as previous…

Quantum computers could potentially simulate the dynamics of systems such as polyatomic molecules on a much larger scale than classical computers. We investigate a general quantum computational algorithm that simulates the time evolution of…

Quantum Physics · Physics 2025-02-18 Yale Fan

Quantum machine learning (QML) seeks to exploit the intrinsic properties of quantum mechanical systems, including superposition, coherence, and quantum entanglement for classical data processing. However, due to the exponential growth of…

Quantum Physics · Physics 2025-10-09 Timothy Heightman , Edward Jiang , Ruth Mora-Soto , Maciej Lewenstein , Marcin Płodzień

The advent of hybrid computing platforms consisting of quantum processing units integrated with conventional high-performance computing brings new opportunities for algorithm design. By strategically offloading select portions of the…

An efficient method of solving the time-dependent Schr\"odinger equation for pure states is described: At each timestep, a restricted subspace of the total Hilbert space is systematically and naturally constructed via the image of repeated…

Quantum Physics · Physics 2026-05-01 R. Kevin Kessing

The main objective of quantum simulation is an in-depth understanding of many-body physics. It is important for fundamental issues (quantum phase transitions, transport, . . . ) and for the development of innovative materials. Analytic…

We develop a means of simulating the evolution and measurement of a multipartite quantum state under discrete or continuous evolution using another quantum system with states and operators lying in a real Hilbert space. This extends…

Quantum Physics · Physics 2009-10-26 Matthew McKague , Michele Mosca , Nicolas Gisin

Quantum computers provide new avenues to access ground and excited state properties of systems otherwise difficult to simulate on classical hardware. New approaches using subspaces generated by real-time evolution have shown efficiency in…

We present a technique designed for parallelizing large rigid body simulations, capable of exploiting multiple CPU cores within a computer and across a network. Our approach can be applied to simulate both unilateral and bilateral…

Graphics · Computer Science 2024-03-27 Manas Kale , Paul G. Kry

State-of-the-art quantum simulators permit local temporal control of interactions and midcircuit readout. These capabilities open the way towards the exploration of intriguing nonequilibrium phenomena. We illustrate this with a kinetically…

Quantum Physics · Physics 2025-06-12 Marcel Cech , María Cea , Mari Carmen Bañuls , Igor Lesanovsky , Federico Carollo