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We address the problem of cooling a Markovian quantum system to a pure state in the shortest amount of time possible. Here the system drift takes the form of a Lindblad master equation and we assume fast unitary control. This setting allows…

Quantum Physics · Physics 2024-03-11 Emanuel Malvetti

Simulated and parallel tempering are families of Markov Chain Monte Carlo algorithms where a temperature parameter is varied during the simulation to overcome bottlenecks to convergence due to multimodality. In this work we introduce and…

Discrete Mathematics · Computer Science 2016-07-20 Nayantara Bhatnagar , Dana Randall

Determining ground state energies of quantum systems by hybrid classical/quantum methods has emerged as a promising candidate application for near-term quantum computational resources. Short of large-scale fault-tolerant quantum computers,…

Quantum Physics · Physics 2016-10-25 Nicholas C. Rubin

Entanglement is a key resource for quantum information technologies ranging from quantum sensing to quantum computing. Conventionally, the entanglement between two coupled qubits is established at the time scale of the inverse of the…

Quantum Physics · Physics 2023-09-12 Zeng-Zhao Li , Weijian Chen , Maryam Abbasi , Kater W. Murch , K. Birgitta Whaley

Simulating quantum many-body systems (QMBS) is one of the long-standing, highly non-trivial challenges in condensed matter physics and quantum information due to the exponentially growing size of the system's Hilbert space. To date, tensor…

Quantum Physics · Physics 2026-02-06 Belal Abouraya , Jirawat Saiphet , Fedor Jelezko , Ressa S. Said

The use of near-term quantum devices that lack quantum error correction, for addressing quantum chemistry and physics problems, requires hybrid quantum-classical algorithms and techniques. Here we present a process for obtaining the…

Quantum Physics · Physics 2023-08-14 Pejman Jouzdani , Stefan Bringuier

We propose a new algorithm for non-equilibrium molecular dynamics simulations of thermal gradients. The algorithm is an extension of the heat exchange algorithm developed by Hafskjold and co-workers [Mol. Phys. 80, 1389 (1993); Mol. Phys.…

Computational Physics · Physics 2015-10-30 P. Wirnsberger , D. Frenkel , C. Dellago

We present a quantum algorithm for simulating a family of Markovian master equations that can be realized through a probabilistic application of unitary channels and state preparation. Our approach employs a second-order product formula for…

Quantum Physics · Physics 2024-07-02 Evan Borras , Milad Marvian

We investigate the possibility of a Markovian quantum master equation (QME) that consistently describes a finite-dimensional system, a part of which is weakly coupled to a thermal bath. In order to preserve complete positivity and trace,…

Quantum Physics · Physics 2024-03-08 Devashish Tupkary , Abhishek Dhar , Manas Kulkarni , Archak Purkayastha

We introduce a parallel, GPU-accelerated implementation of the iterative qubit coupled cluster (iQCC) method that overcomes the exponential growth of the transformed Hamiltonian -- the principal bottleneck for classical emulation of quantum…

Quantum Physics · Physics 2026-03-11 Seyyed Mehdi Hosseini Jenab , Brandon Henderson , Scott N. Genin

Classical information loading is an essential task for many processing quantum algorithms, constituting a cornerstone in the field of quantum machine learning. In particular, the embedding techniques based on Hamiltonian simulation…

Optimizing open quantum system evolution is an important step on the way to achieving quantum computing and quantum thermodynamic tasks. In this article, we approach optimisation via variational principles and derive an open quantum system…

Quantum Physics · Physics 2018-10-17 Nishchay Suri , Felix C. Binder , Bhaskaran Muralidharan , Sai Vinjanampathy

We propose a protocol for effectively implementing complex-balanced thermalization via Markovian processes on a quantum-circuit platform that couples the system with engineered reservoir qubits. The non-orthogonality of qubit eigenstates…

Quantum Physics · Physics 2026-01-09 Yiting Mao , Peigeng Zhong , Haiqing Lin , Xiaoqun Wang , Shijie Hu

Starting from an arbitrary full-rank state of a lattice quantum spin system, we define a "canonical purified Hamiltonian" and characterize its spectral gap in terms of a spatial mixing condition (or correlation decay) of the state. When the…

Quantum Physics · Physics 2025-05-15 Angelo Lucia , David Pérez-García , Antonio Pérez-Hernández

We prove that any one-dimensional (1D) quantum state with small quantum conditional mutual information in all certain tripartite splits of the system, which we call a quantum approximate Markov chain, can be well-approximated by a Gibbs…

Quantum Physics · Physics 2019-08-13 Kohtaro Kato , Fernando G. S. L. Brandao

We present an efficient sampling method for computing a partition function and accelerating configuration sampling. The method performs a random walk in the $\lambda$ space, with $\lambda$ being any thermodynamic variable that characterizes…

Computational Physics · Physics 2010-03-02 Cheng Zhang , Jianpeng Ma

In numerical studies of the dynamics of unbound quantum mechanical systems, absorbing boundary conditions are frequently applied. Although this certainly provides a useful tool in facilitating the description of the system, its applications…

Quantum Physics · Physics 2015-05-13 Sølve Selstø , Simen Kvaal

Conventional methods of quantum simulation involve trade-offs that limit their applicability to specific contexts where their use is optimal. In particular, the interaction picture simulation has been found to provide substantial asymptotic…

Quantum Physics · Physics 2022-08-17 Abhishek Rajput , Alessandro Roggero , Nathan Wiebe

The thermodynamics of quantum systems coupled to periodically modulated heat baths and work reservoirs is developed. By identifying affinities and fluxes, the first and second law are formulated consistently. In the linear response regime,…

Statistical Mechanics · Physics 2016-06-29 Kay Brandner , Udo Seifert

This work introduces novel numerical algorithms for computational quantum mechanics, grounded in a representation of the Laplace operator -- frequently used to model kinetic energy in quantum systems -- via the heat semigroup. The key…

Quantum Physics · Physics 2025-01-16 Evgueni Dinvay