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Quantum computing allows for the manipulation of highly correlated states whose properties quickly go beyond the capacity of any classical method to calculate. Thus one natural problem which could lend itself to quantum advantage is the…

Quantum Physics · Physics 2024-12-19 Kevin Lively , Tim Bode , Jochen Szangolies , Jian-Xin Zhu , Benedikt Fauseweh

Recent quantum algorithms pertaining to electronic structure theory primarily focus on threshold-based dynamic construction of ansatz by selectively including important many-body operators. These methods can be made systematically more…

Quantum Physics · Physics 2024-08-26 Chayan Patra , Debaarjun Mukherjee , Sonaldeep Halder , Dibyendu Mondal , Rahul Maitra

Molecular quantum simulations with the variational quantum eigensolver (VQE) rely on ansatz states that approximate the molecular ground states. These ansatz states are generally defined by parametrized fermionic excitation operators and an…

Quantum Physics · Physics 2021-01-04 Yordan S. Yordanov , David R. M. Arvidsson-Shukur , Crispin H. W. Barnes

Simulating molecular systems on quantum processors has the potential to surpass classical methods in computational resource efficiency. The limited qubit connectivity, small processor size, and short coherence times of near-term quantum…

Quantum Physics · Physics 2025-04-08 Abhishek Sadhu , Aritra Sarkar , Akash Kundu

The variational quantum eigensolver (VQE) algorithm recently became a popular method to compute quantum chemical properties of molecules on noisy intermediate scale quantum (NISQ) devices. In order to avoid noise accumulation from the NISQ…

Quantum Physics · Physics 2023-08-29 Seyed Ehsan Ghasempouri , Gerhard W. Dueck , Stijn De Baerdemacker

Quantum embedding is an appealing route to fragment a large interacting quantum system into several smaller auxiliary `cluster' problems to exploit the locality of the correlated physics. In this work we critically review approaches to…

Strongly Correlated Electrons · Physics 2023-07-19 Max Nusspickel , Basil Ibrahim , George H. Booth

Recent years have seen unprecedented advance in the design and control of quantum computers. Nonetheless, their applicability is still restricted and access remains expensive. Therefore, a substantial amount of quantum algorithms research…

Quantum Physics · Physics 2020-12-11 Thomas Grurl , Richard Kueng , Jürgen Fuß , Robert Wille

Quantum circuit optimization - the process of transforming a quantum circuit into an equivalent one with reduced time and space requirements - is crucial for maximizing the utility of current and near-future quantum devices. While most…

Quantum Physics · Physics 2026-01-23 Marcin Szyniszewski , Aleks Kissinger , Noah Linden , Paul Skrzypczyk

The current phase of quantum computing is in the Noisy Intermediate-Scale Quantum (NISQ) era. On NISQ devices, two-qubit gates such as CNOTs are much noisier than single-qubit gates, so it is essential to minimize their count. Quantum…

Quantum Physics · Physics 2022-03-24 Xin-Chuan Wu , Marc Grau Davis , Frederic T. Chong , Costin Iancu

A quantum circuit is generalized to a nonunitary one whose constituents are nonunitary gates operated by quantum measurement. It is shown that a specific type of one-qubit nonunitary gates, the controlled-NOT gate, as well as all one-qubit…

Quantum Physics · Physics 2011-01-11 Hiroaki Terashima , Masahito Ueda

A robust system for use of Quantum Computation using neutral atoms is presented in this communication. This scheme exploits a multilevel atomic system interacting with two lasers in such a way that it leads to formation of two Coherent…

Quantum Physics · Physics 2012-09-03 Ashok Vudayagiri

Understanding the effects of noise on quantum computations is fundamental to the development of quantum hardware and quantum algorithms. Simulation tools are essential for quantitatively modelling these effects, yet unless artificial…

Quantum Physics · Physics 2025-10-07 Anthony P. Thompson , Arie Soeteman , Chris Cade , Ido Niesen

The factorized form of the unitary coupled-cluster approximation is one of the most promising methodologies to prepare trial states for strongly correlated systems within the variational quantum eigensolver framework. The factorized form of…

Quantum Physics · Physics 2022-01-05 Luogen Xu , Joseph T. Lee , J. K. Freericks

Quantum-circuit optimization is essential for any practical realization of quantum computation, in order to beat decoherence. We present a scheme for implementing the final stage in the compilation of quantum circuits, i.e., for finding the…

Quantum Physics · Physics 2007-05-23 Juha J. Vartiainen , Antti O. Niskanen , Mikio Nakahara , Martti M. Salomaa

Current quantum computers suffer from a limited number of qubits and high error rates, limiting practical applicability. Different techniques exist to mitigate these effects and run larger algorithms. In this work, we analyze one of these…

Quantum Physics · Physics 2026-02-04 Michel Meulen , Niels M. P. Neumann , Jasper Verbree

The aim of this work is to study the physical properties of a one-way quantum computer in an effective low-energy cluster state. We calculate the optimal working conditions as a function of the temperature and of the system parameters. The…

Quantum Physics · Physics 2011-11-28 D. Klagges , K. P. Schmidt

Arithmetic operations are an important component of many quantum algorithms. As such, coming up with optimized quantum circuits for these operations leads to more efficient implementations of the corresponding algorithms. In this paper, we…

Quantum Physics · Physics 2026-03-20 Priyanka Mukhopadhyay , Alexandru Gheorghiu , Hari Krovi

We propose a streamlined combination scheme of the transcorrelation (TC) and coupled cluster (CC) theory, which not only increases the convergence rate with respect to the basis set, but also extends the applicability of the lowest order CC…

Strongly Correlated Electrons · Physics 2021-07-28 Ke Liao , Thomas Schraivogel , Hongjun Luo , Daniel Kats , Ali Alavi

During the noisy intermediate-scale quantum (NISQ) era, it is important to optimize the quantum circuits in circuit depth and gate count, especially entanglement gates, including the CNOT gate. Among all the unitary operators, diagonal…

Quantum Physics · Physics 2024-04-15 Xinchi Huang , Taichi Kosugi , Hirofumi Nishi , Yu-ichiro Matsushita

Overcoming the influence of noise and imperfections is a major challenge in quantum computing. Here, we present an approach based on applying a desired unitary computation in superposition between the system of interest and some auxiliary…

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