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Quantum computing brings a promise of new approaches into computational quantum chemistry. While universal, fault-tolerant quantum computers are still not available, we want to utilize today's noisy quantum processors. One of their flagship…

The variational quantum eigensolver (VQE) is a hybrid quantum-classical algorithm designed for current and near-term quantum devices. Despite its initial success, there is a lack of understanding involving several of its key aspects. There…

Quantum Physics · Physics 2023-03-22 Manpreet Singh Jattana , Fengping Jin , Hans De Raedt , Kristel Michielsen

Performing experiments on small-scale quantum computers is certainly a challenging endeavor. Many parameters need to be optimized to achieve high-fidelity operations. This can be done efficiently for operations acting on single qubits as…

Quantum Physics · Physics 2016-08-31 M. Müller , A. Rivas , E. A. Martínez , D. Nigg , P. Schindler , T. Monz , R. Blatt , M. A. Martin-Delgado

The preparation of a given quantum state on a quantum computing register is a typically demanding operation, requiring a number of elementary gates that scales exponentially with the size of the problem. Using the adiabatic theorem for…

Quantum Physics · Physics 2025-01-14 Davide Cugini , Davide Nigro , Mattia Bruno , Dario Gerace

Quantum computers attract much attention as they promise to outperform their classical counterparts in solving certain type of problems. One of them with practical applications in quantum chemistry is simulation of complex quantum systems.…

Quantum Physics · Physics 2014-07-08 Libor Veis , Jiří Pittner

Designing proper time-dependent control fields for slowly varying the system to the ground state that encodes the problem solution is crucial for adiabatic quantum computation. However, inevitable perturbations in real applications demand…

Quantum Physics · Physics 2020-07-22 Xiaodong Yang , Ran Liu , Jun Li , Xinhua Peng

We propose a state-specific orbital optimization scheme for improving the accuracy of excited states of the electronic structure Hamiltonian for the use on near-term quantum computers, which can be combined with any overlap-based…

Quantum Physics · Physics 2025-10-16 Guorui Zhu , Joel Bierman , Jianfeng Lu , Yingzhou Li

Quantum annealing is a method developed to solve combinatorial optimization problems by utilizing quantum bits. Solving such problems corresponds to minimizing a cost function defined over binary variables. However, in many practical cases,…

Quantum Physics · Physics 2025-06-26 Seiya Endo , Shohei Kawakatsu , Hiromichi Matsuyama , Kohei Suzuki , Yuichiro Matsuzaki

Quantum simulators offer the potential to utilize the quantum nature of a physical system to study another physical system. In contrast to conventional simulation, which experiences an exponential increase in computational complexity,…

Quantum Physics · Physics 2024-07-24 Xuliang Du , Yang Shen , Zipeng Wu , Bei Zeng , Sen Yang

Hybrid quantum-classical embedding methods for correlated materials simulations provide a path towards potential quantum advantage. However, the required quantum resources arising from the multi-band nature of $d$ and $f$ electron materials…

Quantum Physics · Physics 2023-01-09 Anirban Mukherjee , Noah F. Berthusen , João C. Getelina , Peter P. Orth , Yong-Xin Yao

Variational algorithms for strongly correlated chemical and materials systems are one of the most promising applications of near-term quantum computers. We present an extension to the variational quantum eigensolver that approximates the…

Quantum Physics · Physics 2020-08-26 William J. Huggins , Joonho Lee , Unpil Baek , Bryan O'Gorman , K. Birgitta Whaley

Quantum Annealing, or Quantum Stochastic Optimization, is a classical randomized algorithm which provides good heuristics for the solution of hard optimization problems. The algorithm, suggested by the behaviour of quantum systems, is an…

Quantum Physics · Physics 2011-07-06 Diego de Falco , Dario Tamascelli

Estimation of physical observables for unknown quantum states is an important problem that underlies a wide range of fields, including quantum information processing, quantum physics, and quantum chemistry. In the context of quantum…

Quantum Physics · Physics 2024-05-21 Yuma Nakamura , Yoshichika Yano , Nobuyuki Yoshioka

Quantum annealing provides a promising route for the development of quantum optimization devices, but the usefulness of such devices will be limited in part by the range of implementable problems as dictated by hardware constraints. To…

Quantum Physics · Physics 2015-10-14 Walter Vinci , Tameem Albash , Gerardo Paz-Silva , Itay Hen , Daniel A. Lidar

Preparing the Gibbs state of an interacting quantum many-body system on noisy intermediate-scale quantum (NISQ) devices is a crucial task for exploring the thermodynamic properties in the quantum regime. It encompasses understanding…

Quantum Physics · Physics 2025-01-08 Mirko Consiglio

Properly designed control has been shown to be particularly advantageous for improving AQC accuracy and time complexity scaling. Here, an \emph{in situ} quantum control optimization protocol is developed to indirectly optimize state…

Quantum Physics · Physics 2019-06-12 Gregory Quiroz

This work introduces a self-learning protocol that incorporates measurement and feedback into variational quantum circuits for efficient quantum state preparation. By combining projective measurements with conditional feedback, the protocol…

Quantum Physics · Physics 2025-07-16 Daniel Alcalde Puente , Matteo Rizzi

A flexible job shop scheduling problem (FJSSP) poses a complex optimization task in modeling real-world process scheduling tasks with conflicting objectives. To tackle FJSSPs, approximation methods are employed to ensure solutions are…

Quantum Physics · Physics 2024-08-29 Philipp Schworm , Xiangqian Wu , Matthias Klar , Jan C. Aurich

Ising machines have the potential to realize fast and highly accurate solvers for combinatorial optimization problems. They are classified based on their internal algorithms. Examples include simulated-annealing-based Ising machines…

Statistical Mechanics · Physics 2023-11-15 Shuta Kikuchi , Nozomu Togawa , Shu Tanaka

Ground-state preparation is an important task in quantum computation. The probabilistic imaginary-time evolution (PITE) method is a promising candidate for preparing the ground state of the Hamiltonian, which comprises a single ancilla…

Quantum Physics · Physics 2023-11-08 Hirofumi Nishi , Koki Hamada , Yusuke Nishiya , Taichi Kosugi , Yu-ichiro Matsushita
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