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Quantum annealing is a computational paradigm in which optimisation problems are mapped onto the energy landscape of an interacting quantum system and explored through its dynamical evolution. By continuously transforming a simple initial…

Quantum Physics · Physics 2026-05-11 Steven Abel , Andrei Constantin , Luca A. Nutricati

Even when starting with a very poor initial guess, the iterative configuration interaction (iCI) approach can converge from above to full CI very quickly by constructing and diagonalizing a small Hamiltonian matrix at each…

Chemical Physics · Physics 2020-01-07 Ning Zhang , Wenjian Liu , Mark R. Hoffmann

Quantum information scrambling (QIS) describes the rapid spread of initially localized information across an entire quantum many-body system through entanglement generation. Once scrambled, the original local information becomes encoded…

This paper proposes a novel optimization framework for discrete phase shifts of a reconfigurable intelligent surface (RIS) using a coherent Ising machine (CIM). Unlike conventional methods based on iterative convex approximation or…

Information Theory · Computer Science 2026-04-01 Yuto Hama , Daisuke Kitayama , Kensuke Inaba , Toshimori Honjo , Hiroki Takesue , Naoki Ishikawa , Hiroyuki Takahashi

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

Quantum Variational Circuits (QVCs) are often claimed as one of the most potent uses of both near term and long term quantum hardware. The standard approaches to optimizing these circuits rely on a classical system to compute the new…

Quantum Physics · Physics 2022-02-11 Owen Lockwood

Variational quantum algorithms, which consist of optimal parameterized quantum circuits, are promising for demonstrating quantum advantages in the noisy intermediate-scale quantum (NISQ) era. Apart from classical computational resources,…

Quantum Physics · Physics 2024-12-30 Chen Qian , Wei-Feng Zhuang , Rui-Cheng Guo , Meng-Jun Hu , Dong E. Liu

Several combinatorial optimization problems can be solved with NISQ devices once that a corresponding quadratic unconstrained binary optimization (QUBO) form is derived. The aim of this work is to drastically reduce the variables needed for…

Quantum Physics · Physics 2026-02-25 Dario De Santis , Salvatore Tirone , Stefano Marmi , Vittorio Giovannetti

This paper proposes a novel combination of constraint encoding methods for the Quantum Approximate Optimization Ansatz (QAOA). Real-world optimization problems typically consist of multiple types of constraints. To solve these optimization…

Quantum algorithms require accurate representations of electronic states on a quantum device, yet the approximation of electronic wave functions for strongly correlated systems remains a profound theoretical challenge, with existing methods…

Quantum Physics · Physics 2025-04-29 Dipanjali Halder , Dibyendu Mondal , Rahul Maitra

Quantum computing holds promise for outperforming classical computing in specialized applications such as optimization. With current Noisy Intermediate Scale Quantum (NISQ) devices, only variational quantum algorithms like the Quantum…

Quantum Physics · Physics 2024-07-08 Daniel Müssig , Markus Wappler , Steve Lenk , Jörg Lässig

Service composition is a widely used method in ubiquitous computing that enables accomplishing complex tasks required by users based on elementary (hardware and software) services available in ubiquitous environments. To ensure that users…

Software Engineering · Computer Science 2016-11-29 Nebil Ben Mabrouk , Nikolaos Georgantas , Valérie Issarny

It is shown that a prechosen set of occupied/virtual valence/core atomic/fragmental orbitals can be transformed to an equivalent set of localized occupied/virtual pre-molecular orbitals (pre-LMO), which can then be taken as probes to select…

Chemical Physics · Physics 2021-05-12 Yibo Lei , Bingbing Suo , Wenjian Liu

Quantum algorithms for selecting a subspace of Hamiltonians to diagonalize have emerged as a promising alternative to variational algorithms in the NISQ era. So far, such algorithms, which include the quantum selected configuration…

Quantum Optimal Control (QOC) is the field devoted to the production of external control protocols that actively guide quantum dynamics. Solutions to QOC problems were shown to constitute continuous submanifolds of control space. A solution…

Quantum Physics · Physics 2020-09-23 Martin Larocca , Esteban A. Calzetta , Diego A. Wisniacki

Quantum computing offers an alternative paradigm for addressing combinatorial optimization problems compared to classical computing. Despite recent hardware improvements, the execution of empirical quantum optimization experiments at scales…

The Coupled Cluster (CC) method is used to compute the electronic correlation energy in atoms and molecules and often leads to highly accurate results. However, due to its single-reference nature, standard CC in its projected form fails to…

The quantum approximate optimisation algorithm (QAOA) is at the core of many scenarios that aim to combine the power of quantum computers and classical high-performance computing appliances for combinatorial optimisation. Several obstacles…

Quantum Physics · Physics 2026-02-26 Simon Thelen , Hila Safi , Wolfgang Mauerer

We propose a scalable encoding of combinatorial optimization problems with arbitrary connectivity, including higher-order terms, on arrays of trapped neutral atoms requiring only a global laser drive. Our approach relies on modular…

Quantum Physics · Physics 2024-10-08 Martin Lanthaler , Kilian Ender , Clemens Dlaska , Wolfgang Lechner

The design of nonlinear superconducting quantum circuits often relies on time-consuming iterative electromagnetic simulations requiring manual intervention. These interventions entail, for example, adjusting design variables such as…