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We develop randomized quantum algorithms to simulate quantum collision models, also known as repeated interaction schemes, which provide a rich framework to model various open-system dynamics. The underlying technique involves composing…

Quantum Physics · Physics 2025-08-20 Kushagra Garg , Zeeshan Ahmed , Subhadip Mitra , Shantanav Chakraborty

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

Hamiltonian simulation is a fundamental algorithm in quantum computing that has attracted considerable interest owing to its potential to efficiently solve the governing equations of large-scale classical systems. Exponential speedup…

Quantum Physics · Physics 2025-08-14 Shoya Sasaki , Katsuhiro Endo , Mayu Muramatsu

We propose a method for constructing $\texttt{PREPARE}$ circuits for quantum phase estimation of a molecular Hamiltonian in quantum chemistry by using variational optimization of quantum circuits solely on classical computers. The…

Quantum Physics · Physics 2025-05-02 Hayata Morisaki , Kosuke Mitarai , Keisuke Fujii , Yuya O. Nakagawa

We significantly enhance the simulation accuracy of initial Trotter circuits for Hamiltonian simulation of quantum systems by integrating first-order Riemannian optimization with tensor network methods. Unlike previous approaches, our…

Quantum Physics · Physics 2025-12-30 Isabel Nha Minh Le , Shuo Sun , Christian B. Mendl

The development of tailored materials for specific applications is an active field of research in chemistry, material science and drug discovery. The number of possible molecules that can be obtained from a set of atomic species grow…

A common approach to minimizing the cost of quantum computations is by transforming a quantum system into a basis that can be optimally truncated. Here, we derive classical equations of motion subjected to similar unitary transformations,…

Quantum Physics · Physics 2024-04-25 Ken Miyazaki , Alex Krotz , Roel Tempelaar

The semiclassically scaled time-dependent multi-particle Schr\"odinger equation describes, inter alia, quantum dynamics of nuclei in a molecule. It poses the combined computational challenges of high oscillations and high dimensions. This…

Numerical Analysis · Mathematics 2020-12-02 Caroline Lasser , Christian Lubich

Stochastic Gradient Descent (SGD) and its variants underpin modern machine learning by enabling efficient optimization of large-scale models. However, their local search nature limits exploration in complex landscapes. In this paper, we…

Quantum Physics · Physics 2025-07-22 Sirui Peng , Shengminjie Chen , Xiaoming Sun , Hongyi Zhou

Simulating quantum dynamics is one of the central applications of quantum computing. For Hamiltonians written as a sum of many terms, deterministic Trotter--Suzuki product formulas can require applying a large number of term-wise evolutions…

Quantum Physics · Physics 2026-05-20 Pegah Mohammadipour , Xiantao Li

We introduce the first randomized algorithms for Quantum Singular Value Transformation (QSVT), a unifying framework for many quantum algorithms. Standard implementations of QSVT rely on block encodings of the Hamiltonian, which are costly…

We propose a new approach to utilize quantum computers for binary linear programming (BLP), which can be extended to general integer linear programs (ILP). Quantum optimization algorithms, hybrid or quantum-only, are currently general…

Data Structures and Algorithms · Computer Science 2026-02-13 András Czégel , Boglárka G. -Tóth

We consider the classical momentum- or velocity-dependent two-dimensional Hamiltonian given by $$\mathcal H_N = p_1^2 + p_2^2 +\sum_{n=1}^N \gamma_n(q_1 p_1 + q_2 p_2)^n ,$$ where $q_i$ and $p_i$ are generic canonical variables, $\gamma_n$…

Mathematical Physics · Physics 2023-01-06 Alfonso Blasco , Ivan Gutierrez-Sagredo , Francisco J. Herranz

Variational Quantum Circuits (VQC) lie at the forefront of quantum machine learning research. Still, the use of quantum networks for real data processing remains challenging as the number of available qubits cannot accommodate a large…

Quantum Physics · Physics 2024-09-06 G. Maragkopoulos , A. Mandilara , A. Tsili , D. Syvridis

We generalize the classical shadow tomography scheme to a broad class of finite-depth or finite-time local unitary ensembles, known as locally scrambled quantum dynamics, where the unitary ensemble is invariant under local basis…

Quantum Physics · Physics 2025-10-27 Hong-Ye Hu , Soonwon Choi , Yi-Zhuang You

The application of quantum algorithms to classical problems is generally accompanied by significant bottlenecks when transferring data between quantum and classical states, often negating any intrinsic quantum advantage. Here we address…

Quantum Physics · Physics 2025-04-03 Omer Rathore , Alastair Basden , Nicholas Chancellor , Halim Kusumaatmaja

In an attempt to better leverage superconducting quantum computers, scaling efforts have become the central concern. These efforts have been further exacerbated by the increased complexity of these circuits. The added complexity can…

Quantum Physics · Physics 2024-06-10 Fadi Wassaf

Recently, there has been growing interest in simulating time-dependent Hamiltonians using quantum algorithms, driven by diverse applications, such as quantum adiabatic computing. While techniques for simulating time-independent Hamiltonian…

Quantum Physics · Physics 2024-11-06 Yu Cao , Shi Jin , Nana Liu

Quantum simulation is known to be capable of simulating certain dynamical systems in continuous time -- Schrodinger's equations being the most direct and well-known -- more efficiently than classical simulation. Any linear dynamical system…

Quantum Physics · Physics 2025-04-22 Shi Jin , Nana Liu

Harnessing the full power of nascent quantum processors requires the efficient management of a limited number of quantum bits with finite lifetime. Hybrid algorithms leveraging classical resources have demonstrated promising initial results…

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