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Accurate quantum chemistry simulations remain challenging on classical computers for problems of industrially relevant sizes and there is reason for hope that quantum computing may help push the boundaries of what is technically feasible.…

量子物理 · 物理学 2021-03-17 Vincent E. Elfving , Marta Millaruelo , José A. Gámez , Christian Gogolin

We describe QWalk, a new computational package capable of performing Quantum Monte Carlo electronic structure calculations for molecules and solids with many electrons. We describe the structure of the program and its implementation of…

计算物理 · 物理学 2007-10-25 Lucas K. Wagner , Michal Bajdich , Lubos Mitas

We present Quantum Brush, an open-source digital painting tool that harnesses quantum computing to generate novel artistic expressions. The tool includes four different brushes that translate strokes into unique quantum algorithms, each…

Quantum computing has the potential to surpass the capabilities of current classical computers when solving complex problems. Combinatorial optimization has emerged as one of the key target areas for quantum computers as problems found in…

量子物理 · 物理学 2023-07-27 Juan Giraldo , José Ossorio , Norha M. Villegas , Gabriel Tamura , Ulrike Stege

Generating a test suite for a quantum program such that it has the maximum number of failing tests is an optimization problem. For such optimization, search-based testing has shown promising results in the context of classical programs. To…

软件工程 · 计算机科学 2022-04-20 Xinyi Wang , Paolo Arcaini , Tao Yue , Shaukat Ali

We are developing a quantum interactive learning tutorial (QuILT) on a quantum eraser for students in upperlevel quantum mechanics. The QuILT exposes students to contemporary topics in quantum mechanics and uses a guided approach to…

物理教育 · 物理学 2016-02-18 Emily Marshman , Chandralekha Singh

The intersection of quantum computing and quantum chemistry represents a promising frontier for achieving quantum utility in domains of both scientific and societal relevance. Owing to the exponential growth of classical resource…

Quantum computing is expected to have transformative influences on many domains, but its practical deployments on industry problems are underexplored. We focus on applying quantum computing to operations management problems in industry, and…

量子物理 · 物理学 2023-01-13 Hansheng Jiang , Zuo-Jun Max Shen , Junyu Liu

Recent advances in quantum computing systems attract tremendous attention. Commercial companies, such as IBM, Amazon, and IonQ, have started to provide access to noisy intermediate-scale quantum computers. Researchers and entrepreneurs…

量子物理 · 物理学 2022-09-26 Wenrui Mu , Ying Mao , Long Cheng , Qingle Wang , Weiwen Jiang , Pin-Yu Chen

Quantum Chemistry (QC) is one of the most promising applications of Quantum Computing. However, present quantum processing units (QPUs) are still subject to large errors. Therefore, noisy intermediate-scale quantum (NISQ) hardware is…

量子物理 · 物理学 2025-10-21 Mohammad Haidar , Marko J. Rančić , Thomas Ayral , Yvon Maday , Jean-Philip Piquemal

Impurities are ubiquitous in condensed matter. Boundary Conformal Field Theory (BCFT) provides a powerful method to study a localized quantum impurity interacting with a gapless continuum of excitations. The results can also be implied to…

强关联电子 · 物理学 2009-12-24 Ian Affleck

We present an introduction to the Quantum Toolbox in Python (QuTiP) in the context of an undergraduate quantum mechanics class and potential senior research projects. QuTiP provides ready-to-use definitions of standard quantum states and…

物理教育 · 物理学 2019-10-01 Andrew M. C. Dawes

This review is designed to introduce mathematicians and computational scientists to quantum computing (QC) through the lens of uncertainty quantification (UQ) by presenting a mathematically rigorous and accessible narrative for…

量子物理 · 物理学 2026-03-30 Ryan Bennink , Olena Burkovska , Konstantin Pieper , Jorge Ramirez , Elaine Wong

We derive exact, universal, closed-form quantum Monte Carlo estimators for finite-temperature energy susceptibility and fidelity susceptibility, applicable to essentially arbitrary Hamiltonians. Combined with recent advancements in Monte…

统计力学 · 物理学 2026-01-30 Nic Ezzell , Lev Barash , Itay Hen

Near term quantum devices have the potential to outperform classical computing through the use of hybrid classical-quantum algorithms such as Variational Quantum Eigensolvers. These iterative algorithms use a classical optimiser to update a…

量子物理 · 物理学 2024-01-17 A. M. Krol , K. Mesman , A. Sarkar , M. Möller , Z. Al-Ars

Treating uncertainties in models is essential in many fields of science and engineering. Uncertainty quantification (UQ) on complex and computationally costly numerical models necessitates a combination of efficient model solvers, advanced…

分布式、并行与集群计算 · 计算机科学 2023-04-28 Linus Seelinger , Anne Reinarz , Jean Benezech , Mikkel Bue Lykkegaard , Lorenzo Tamellini , Robert Scheichl

When noisy intermediate scalable quantum (NISQ) devices are applied in information processing, all of the stages through preparation, manipulation, and measurement of multipartite qubit states contain various types of noise that are…

量子物理 · 物理学 2021-12-16 Hyeokjea Kwon , Joonwoo Bae

We investigate in this work a recently proposed diagrammatic quantum Monte Carlo method --- the inchworm Monte Carlo method --- for open quantum systems. We establish its validity rigorously based on resummation of Dyson series. Moreover,…

数学物理 · 物理学 2019-06-18 Zhenning Cai , Jianfeng Lu , Siyao Yang

Fault-tolerant quantum computation promises to solve outstanding problems in quantum chemistry within the next decade. Realizing this promise requires scalable tools that allow users to translate descriptions of electronic structure…

Quantum computing (QC) promises to be a transformative technology with impact on various application domains, such as optimization, cryptography, and material science. However, the technology has a sharp learning curve, and practical…