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With the development of low order scaling methods for performing Kohn-Sham Density Functional Theory, it is now possible to perform fully quantum mechanical calculations of systems containing tens of thousands of atoms. However, with an…

Chemical Physics · Physics 2020-04-03 William Dawson , Stephan Mohr , Laura E. Ratcliff , Takahito Nakajima , Luigi Genovese

We develop and implement automated methods for optimizing quantum circuits of the size and type expected in quantum computations that outperform classical computers. We show how to handle continuous gate parameters and report a collection…

Quantum Physics · Physics 2018-06-04 Yunseong Nam , Neil J. Ross , Yuan Su , Andrew M. Childs , Dmitri Maslov

Efficient simulation of quantum computers is essential for the development and validation of near-term quantum devices and the research on quantum algorithms. Up to date, two main approaches to simulation were in use, based on either full…

Computational Complexity · Computer Science 2020-05-06 Roman Schutski , Danil Lykov , Ivan Oseledets

With the rapid progress in quantum hardware and software, the need for verification of quantum systems becomes increasingly crucial. While model checking is a dominant and very successful technique for verifying classical systems, its…

Data Structures and Algorithms · Computer Science 2025-03-07 Xin Hong , Dingchao Gao , Sanjiang Li , Shenggang Ying , Mingsheng Ying

We study the problem of compilation of quantum algorithms into optimized physical-level circuits executable in a quantum information processing (QIP) experiment based on trapped atomic ions. We report a complete strategy: starting with an…

Quantum Physics · Physics 2017-02-22 Dmitri Maslov

While the ability to build quantum computers is improving dramatically, developing quantum algorithms is limited and relies on human insight and ingenuity. Although a number of quantum programming languages have been developed, it is…

Software Engineering · Computer Science 2022-10-07 Kentaro Murakami , Jianjun Zhao

While quantum machine learning (ML) has been proposed to be one of the most promising applications of quantum computing, how to build quantum ML models that outperform classical ML remains a major open question. Here, we demonstrate a…

Quantum Physics · Physics 2023-03-10 Elham Torabian , Roman V. Krems

Representations of quantum computations are almost always based on a tensor product $\otimes$-structure. This coincides with what we are able to execute in our experiments, as well as what we observe in Nature, but it makes certain familiar…

Quantum Physics · Physics 2021-11-05 Luca Mondada

In this thesis, we investigate whether quantum algorithms can be used in the field of machine learning for both long and near term quantum computers. We will first recall the fundamentals of machine learning and quantum computing and then…

Quantum Physics · Physics 2021-11-08 Jonas Landman

Demonstrating quantum advantage has been a pressing challenge in the field. Most claimed quantum speedups rely on a subroutine in which classical information can be accessed in a coherent quantum manner, which imposes a crucial constraint…

Quantum Physics · Physics 2025-11-04 Nhat A. Nghiem

Quantum algorithms for graph problems are considered, both in the adjacency matrix model and in an adjacency list-like array model. We give almost tight lower and upper bounds for the bounded error quantum query complexity of Connectivity,…

Quantum Physics · Physics 2016-12-30 Christoph Durr , Mark Heiligman , Peter Hoyer , Mehdi Mhalla

Solving linear systems is at the foundation of many algorithms. Recently, quantum linear system algorithms (QLSAs) have attracted great attention since they converge to a solution exponentially faster than classical algorithms in terms of…

Quantum Physics · Physics 2024-04-01 Zeguan Wu , Sidhant Misra , Tamás Terlaky , Xiu Yang , Marc Vuffray

Near-term quantum devices generally suffer from shallow circuit depth and hence limited expressivity due to noise and decoherence. To address this, we propose tensor-network-assisted parametrized quantum circuits, which concatenate a…

Quantum Physics · Physics 2023-12-01 Junxiang Huang , Wenhao He , Yukun Zhang , Yusen Wu , Bujiao Wu , Xiao Yuan

Quantum circuits that generate coherent superpositions of stochastic processes are key to many downstream quantum-accelerated tasks, such as risk analysis, importance sampling, and DNA sequencing. However, traditional methods for designing…

Quantum Physics · Physics 2026-03-26 Ximing Wang , Chengran Yang , Chidambaram Aditya Somasundaram , Jayne Thompson , Mile Gu

Quantum computing (QC) provides a promising avenue toward enabling quantum chemistry calculations, which are classically impossible due to a computational complexity that increases exponentially with system size. As fully fault-tolerant…

Large scale numerical experiments are commonplace today in theoretical physics. The high performance algorithms described herein are the most compact, efficient methods known for representing and analyzing systems modeled well by sets or…

General Relativity and Quantum Cosmology · Physics 2018-05-14 William J. Cunningham

Combinatorial optimization is a promising application for near-term quantum computers, however, identifying performant algorithms suited to noisy quantum hardware remains as an important goal to potentially realizing quantum computational…

Quantum Physics · Physics 2025-04-01 Titus D. Morris , Ananth Kaushik , Martin Roetteler , Phillip C. Lotshaw

Classical data encoding is usually treated as a black-box in the oracle-based quantum algorithms. On the other hand, their constructions are crucial for practical algorithm implementations. Here, we open the black-boxes of data encoding and…

Quantum Physics · Physics 2024-04-30 Xiao-Ming Zhang , Xiao Yuan

Protein design is a technique to engineer proteins by modifying their sequence to obtain novel functionalities. In this method, amino acids in the sequence are permutated to find the low energy states satisfying the configuration. However,…

Quantitative Methods · Quantitative Biology 2023-05-10 Mohammad Hassan Khatami , Udson C. Mendes , Nathan Wiebe , Philip M. Kim

At the moment, quantum circuits are created mainly by manually placing logic elements on lines that symbolize quantum bits. The purpose of creating Quantum Circuit Synthesizer "Naginata" was due to the fact that even with a slight increase…

Quantum Physics · Physics 2022-09-22 Cesar Borisovich Pronin , Andrey Vladimirovich Ostroukh