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Despite significant work on resource estimation for quantum simulation of electronic systems, the challenge of preparing states with sufficient ground state support has so far been largely neglected. In this work we investigate this issue…

Calculating the molecular ground-state energy is a central challenge in computational chemistry. Conventional methods such as the Complete Active Space Configuration Interaction scale exponentially with molecular size, limiting their…

Quantum Physics · Physics 2025-12-15 Stefano Bruni , Enrico Prati

Quantum annealing aims at finding optimal solutions to complex optimization problems using a suitable quantum many body Hamiltonian encoding the solution in its ground state. To find the solution one typically evolves the ground state of a…

Quantum Physics · Physics 2022-05-13 Elias Starchl , Helmut Ritsch

The computational power of quantum computers poses major challenges to new design tools since representing pure quantum states typically requires exponentially large memory. As shown previously, decision diagrams can reduce these memory…

Quantum Physics · Physics 2023-11-08 Alwin Zulehner , Stefan Hillmich , Igor L. Markov , Robert Wille

The discovery of topological order has revolutionized the understanding of quantum matter in modern physics and provided the theoretical foundation for many quantum error correcting codes. Realizing topologically ordered states has proven…

Quantum chemistry is envisioned as an early and disruptive application for quantum computers. Yet, closer scrutiny of the proposed algorithms shows that there are considerable difficulties along the way. Here, we propose two criteria for…

Quantum Physics · Physics 2026-04-09 Thibaud Louvet , Thomas Ayral , Xavier Waintal

We present a quantum embedding methodology to resolve the Anderson impurity model in the context of dynamical mean-field theory, based on an extended exact diagonalization method. Our method provides a maximally localized quantum impurity…

Strongly Correlated Electrons · Physics 2021-02-19 Carla Lupo , François Jamet , Terence Tse , Ivan Rungger , Cedric Weber

Accurately estimating the overlap between quantum states is a fundamental task in quantum information processing. While various strategies using distinct quantum measurements have been proposed for overlap estimation, the lack of…

Quantum Physics · Physics 2025-02-13 Hao Zhan , Ben Wang , Minghao Mi , Jie Xie , Liang Xu , Aonan Zhang , Lijian Zhang

We introduce a sum-of-squares SDP hierarchy approximating the ground-state energy from below for quantum many-body problems, with a natural quantum embedding interpretation. We establish the connections between our approach and other…

Quantum Physics · Physics 2023-05-31 Bowen Li , Jianfeng Lu

Under suitable assumptions, the algorithms in [Lin, Tong, Quantum 2020] can estimate the ground state energy and prepare the ground state of a quantum Hamiltonian with near-optimal query complexities. However, this is based on a block…

Quantum Physics · Physics 2022-10-19 Yulong Dong , Lin Lin , Yu Tong

Protein characterization is one of the key components for understanding the human body and advancing drug discovery processes. While the future of quantum hardware holds the potential to accurately characterize these molecules, current…

Quantum Physics · Physics 2025-05-05 Laia Coronas Sala , Parfait Atchade-Adelemou

The task of estimating the ground state of Hamiltonians is an important problem in physics with numerous applications ranging from solid-state physics to combinatorial optimization. We provide a hybrid quantum-classical algorithm for…

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

We propose a method for the implementation of one-way quantum computing in superconducting circuits. Measurement-based quantum computing is a universal quantum computation paradigm in which an initial cluster-state provides the quantum…

Quantum machine learning algorithms have emerged to be a promising alternative to their classical counterparts as they leverage the power of quantum computers. Such algorithms have been developed to solve problems like electronic structure…

Chemical Physics · Physics 2021-10-29 Manas Sajjan , Shree Hari Sureshbabu , Sabre Kais

The quantum-computational cost of determining ground state energies through quantum phase estimation depends on the overlap between an easily preparable initial state and the targeted ground state. The Van Vleck orthogonality catastrophe…

Universal fault-tolerant quantum computers will require error-free execution of long sequences of quantum gate operations, which is expected to involve millions of physical qubits. Before the full power of such machines will be available,…

Determining the exponentially scaled ground state wavefunction and the associated molecular properties remains one of the central challenges in quantum chemistry. Hybrid quantum-classical algorithms implemented on quantum computers offer a…

Quantum Physics · Physics 2026-04-22 Dibyendu Mondal , Ashish Kumar Patra , Rahul Maitra

We adapt the robust phase estimation algorithm to the evaluation of energy differences between two eigenstates using a quantum computer. This approach does not require controlled unitaries between auxiliary and system registers or even a…

Quantum Physics · Physics 2021-06-02 A. E. Russo , K. M. Rudinger , B. C. A. Morrison , A. D. Baczewski

We propose an approach to reconstruct any superconducting charge qubit state by using quantum state tomography. This procedure requires a series of measurements on a large enough number of identically prepared copies of the quantum system.…

Quantum Physics · Physics 2009-11-10 Yu-xi Liu , L. F. Wei , Franco Nori

A major bottleneck in the quest for scalable many-body quantum technologies is the difficulty in benchmarking their preparations, which suffer from an exponential `curse of dimensionality' inherent to their quantum states. We present an…

Quantum Physics · Physics 2019-07-31 Juan Carrasquilla , Giacomo Torlai , Roger G. Melko , Leandro Aolita