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In recent years, the Variational Quantum Eigensolver (VQE) has emerged as one of the most popular algorithms for solving the electronic structure problem on near-term quantum computers. The utility of VQE is often hindered by the…

Quantum Physics · Physics 2026-02-04 M. R. Nirmal , Ankit Khandelwal , Manoj Nambiar , Sharma S. R. K. C. Yamijala

Highly entangled quantum states are an ingredient in numerous applications in quantum computing. However, preparing these highly entangled quantum states on currently available quantum computers at high fidelity is limited by ubiquitous…

Quantum Physics · Physics 2025-02-27 Sebastian Brandhofer , Ilia Polian , Stefanie Barz , Daniel Bhatti

Solving partial differential equations for extremely large-scale systems within a feasible computation time serves in accelerating engineering developments. Quantum computing algorithms, particularly the Hamiltonian simulations, present a…

Quantum Physics · Physics 2024-09-10 Yuki Sato , Ruho Kondo , Ikko Hamamura , Tamiya Onodera , Naoki Yamamoto

We describe an algorithm that computes the ground state energy and correlation functions for 2-local Hamiltonians in which interactions between qubits are weak compared to single-qubit terms. The running time of the algorithm is polynomial…

Quantum Physics · Physics 2009-11-13 Sergey Bravyi , David DiVincenzo , Daniel Loss

Artificial neural networks have been recently introduced as a general ansatz to compactly represent many- body wave functions. In conjunction with Variational Monte Carlo, this ansatz has been applied to find Hamil- tonian ground states and…

Strongly Correlated Electrons · Physics 2018-10-24 Kenny Choo , Giuseppe Carleo , Nicolas Regnault , Titus Neupert

In this paper we discuss the utilization of Variational Quantum Solver (VQE) and recently introduced Generalized Unitary Coupled Cluster (GUCC) formalism for the diagonalization of downfolded/effective Hamiltonians in active spaces. In…

Quantum Physics · Physics 2020-11-05 Nicholas P. Bauman , Jaroslav Chládek , Libor Veis , Jiří Pittner , Karol Kowalski

Recently, there has been a growing literature exploring the generalization of quantum algorithms, such that different quantum algorithms are special examples of a more fundamental structure. In this short paper, we provide a general…

Quantum Physics · Physics 2024-10-17 Tomer Shushi

Quantum algorithms are of great interest for their possible use in optimization problems. In particular, variational algorithms that use classical counterparts to optimize parameters hold promise for use in currently existing devices.…

Quantum Physics · Physics 2026-05-13 Bruno Oziel Fernandez , Rodrigo Bloot , Marcelo Moret

Early but promising results in quantum computing have been enabled by the concurrent development of quantum algorithms, devices, and materials. Classical simulation of quantum programs has enabled the design and analysis of algorithms and…

Quantum Physics · Physics 2022-05-17 Bo Fang , M. Yusuf Özkaya , Ang Li , Ümit V. Çatalyürek , Sriram Krishnamoorthy

In the noisy intermediate-scale quantum era, variational quantum algorithms (VQAs) have emerged as a promising avenue to obtain quantum advantage. However, the success of VQAs depends on the expressive power of parameterised quantum…

Quantum Physics · Physics 2024-05-15 Yingli Yang , Zongkang Zhang , Anbang Wang , Xiaosi Xu , Xiaoting Wang , Ying Li

Solving for the lowest energy eigenstate of the many-body Schrodinger equation is a cornerstone problem that hinders understanding of a variety of quantum phenomena. The difficulty arises from the exponential nature of the Hilbert space…

The preparation of Gibbs thermal states is an important task in quantum computation with applications in quantum simulation, quantum optimization, and quantum machine learning. However, many algorithms for preparing Gibbs states rely on…

Quantum Physics · Physics 2022-03-25 Ada Warren , Linghua Zhu , Nicholas J. Mayhall , Edwin Barnes , Sophia E. Economou

By design, the variational quantum eigensolver (VQE) strives to recover the lowest-energy eigenvalue of a given Hamiltonian by preparing quantum states guided by the variational principle. In practice, the prepared quantum state is…

Quantum Physics · Physics 2021-06-29 Daniel Claudino , Jerimiah Wright , Alexander J. McCaskey , Travis S. Humble

Estimating the ground-state energy of Hamiltonians is a fundamental task for which it is believed that quantum computers can be helpful. Several approaches have been proposed toward this goal, including algorithms based on quantum phase…

Quantum Physics · Physics 2025-11-26 Dhrumil Patel , Daniel Koch , Saahil Patel , Mark M. Wilde

We introduce multiple parametrized circuit ans\"atze and present the results of a numerical study comparing their performance with a standard Quantum Alternating Operator Ansatz approach. The ans\"atze are inspired by mixing and phase…

Quantum Physics · Physics 2023-01-27 Ryan LaRose , Eleanor Rieffel , Davide Venturelli

The variational quantum eigen solver (VQE), has been widely used to find the ground state energy of different Hamiltonians with no analytical solutions and are classically difficult to compute. In our work, we have used VQE to identify the…

Quantum Physics · Physics 2026-01-08 Mrinal Dev , Shraddha Sharma

Quantum simulation can help us study poorly understood topics such as high-temperature superconductivity and drug design. However, existing quantum simulation algorithms for current quantum computers often have drawbacks that impede their…

Quantum Physics · Physics 2022-02-28 Kishor Bharti , Tobias Haug

Variational quantum algorithms (VQAs) are a modern family of quantum algorithms designed to solve optimization problems using a quantum computer. Typically VQAs rely on a feedback loop between the quantum device and a classical optimization…

Quantum Physics · Physics 2022-08-26 Alexey Uvarov

We demonstrate that a quantum annealer can be used to solve the NP-complete problem of graph partitioning into subgraphs containing Hamiltonian cycles of constrained length. We present a method to find a partition of a given directed graph…

Quantum Physics · Physics 2021-04-21 Eugenio Cocchi , Edoardo Tignone , Davide Vodola

The variational approach is a cornerstone of computational physics, considering both conventional and quantum computing computational platforms. The variational quantum eigensolver (VQE) algorithm aims to prepare the ground state of a…

Quantum Physics · Physics 2022-12-16 Nikita Astrakhantsev , Guglielmo Mazzola , Ivano Tavernelli , Giuseppe Carleo