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Quantum computers have the potential to simulate chemical systems beyond the capability of classical computers. Recent developments in hybrid quantum-classical approaches enable the determinations of the ground or low energy states of…

Quantum Physics · Physics 2021-12-06 Chee-Kong Lee , Jonathan Wei Zhong Lau , Liang Shi , Leong Chuan Kwek

Numerical simulation is an important method for verifying the quantum circuits used to simulate low-energy nuclear states. However, real-world applications of quantum computing for nuclear theory often generate deep quantum circuits that…

Quantum Physics · Physics 2024-06-06 Ang Li , Alessandro Baroni , Ionel Stetcu , Travis S. Humble

We found that the actual computational time-cost of the QFT is O(n 2^n) for large n in a quantum computer using nuclear spins. The computational cost of a quantum algorithm has usually been estimated as the sum of the universal gates…

Quantum Physics · Physics 2007-05-23 A. Saito , K. Kioi , Y. Akagi , N. Hashizume , K. Ohta

The quantum kernel method has attracted considerable attention in the field of quantum machine learning. However, exploring the applicability of quantum kernels in more realistic settings has been hindered by the number of physical qubits…

Quantum Physics · Physics 2023-09-12 Teppei Suzuki , Tsubasa Miyazaki , Toshiki Inaritai , Takahiro Otsuka

Fault-tolerant quantum computing is a promising tool for simulating molecules and materials, but frequently-considered applications require substantial resources, and the gap between hardware capabilities and requirements remains…

The question of the energetic efficiency of quantum computers has gained increasing attention recently. A precise understanding of the resources required to operate a quantum computer with a targeted computational performance and how the…

Quantum Physics · Physics 2026-05-19 Francisca Góis , Marco Pezzutto , Yasser Omar

Quantum chemistry simulations that accurately predict the properties of materials are among the most highly anticipated applications of quantum computing. It is widely believed that simulations running on quantum computers will allow for…

In this extended abstract, we have introduced a highly memory-efficient state vector simulation of quantum circuits premised on data compression, harnessing the capabilities of both CPUs and GPUs. We have elucidated the inherent challenges…

Quantum Physics · Physics 2023-10-02 Boyuan Zhang , Bo Fang , Qiang Guan , Ang Li , Dingwen Tao

Quantum computing is a hotspot technology for its potential to accelerate specific applications by exploiting quantum parallelism. However, current physical quantum computers are limited to a relatively small scale, simulators based on…

Quantum Physics · Physics 2022-11-15 Jingcheng Shen , Linbo Long , Masao Okita , Fumihiko Ino

Fast execution of complex quantum circuit simulations are crucial for verification of theoretical algorithms paving the way for their successful execution on the quantum hardware. However, the main stream CPU-based platforms for circuit…

Quantum Physics · Physics 2025-06-23 Ziqing Guo , Ziwen Pan , Jan Balewski

High-performance techniques to simulate quantum programs on classical hardware rely on exponentially large vectors to represent quantum states. When simulating quantum algorithms, the quantum states that occur are often sparse due to…

Quantum Physics · Physics 2021-05-05 Samuel Jaques , Thomas Häner

We implement the first open-source quantum computing emulator that includes arithmetic operations, the quantum Fourier transform, and quantum phase estimation. The emulator provides significant savings in both temporal and spatial resources…

Quantum Physics · Physics 2026-01-30 Reece Robertson , Dan Ventura

Since simulating quantum computers requires exponentially more classical resources, efficient algorithms are extremely helpful. We analyze algorithms that create single qubit and specific controlled qubit matrix representations of gates.…

Quantum Physics · Physics 2007-05-23 Eric Hsu

Classical simulators play a major role in the development and benchmark of quantum algorithms and practically any software framework for quantum computation provides the option of running the algorithms on simulators. However, the…

Quantum Physics · Physics 2022-05-04 Gian Giacomo Guerreschi

As quantum computers of non-trivial size become available in the near future, it is imperative to develop tools to emulate small quantum computers. This allows for validation and debugging of algorithms as well as exploring…

Quantum Physics · Physics 2018-01-24 Thomas Häner , Damian S. Steiger , Mikhail Smelyanskiy , Matthias Troyer

Quantum Phase Estimation (QPE) is a cornerstone algorithm for fault-tolerant quantum computation, especially for electronic structure calculations of chemical systems. To accommodate the diverse characteristics of quantum chemical systems,…

Quantum Physics · Physics 2025-10-03 Calvin Ku , Yu-Cheng Chen , Alice Hu , Min-Hsiu Hsieh

The ability to perform ab initio molecular dynamics simulations using potential energies calculated on quantum computers would allow virtually exact dynamics for chemical and biochemical systems, with substantial impacts on the fields of…

We present an asymptotically improved algorithm for implementing the Quantum Fourier Transform (QFT) in both the exact and approximate settings. Historically, the approximate QFT has been implemented in $\Theta(n \log n)$ gates, and the…

Quantum Physics · Physics 2025-02-11 Ronit Shah

Quantum coherence allows for reduced-memory simulators of classical processes. Using recent results in single-shot quantum thermodynamics, we derive a minimal work cost rate for quantum simulators that is quasistatically attainable in the…

Quantum Physics · Physics 2020-07-15 Samuel P. Loomis , James P. Crutchfield

Quantum computing hardware is undergoing rapid development from proof-of-principle devices to scalable machines that could eventually challenge classical supercomputers on specific tasks. On platforms with local connectivity, the transition…

Quantum Physics · Physics 2020-04-13 Adam Holmes , Sonika Johri , Gian Giacomo Guerreschi , James S. Clarke , A. Y. Matsuura
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