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Path integral-based simulation methodologies play a crucial role for the investigation of nuclear quantum effects by means of computer simulations. However, these techniques are significantly more demanding than corresponding classical…

Statistical Mechanics · Physics 2018-01-17 Karsten Kreis , Kurt Kremer , Raffaello Potestio , Mark E. Tuckerman

The capabilities of image probe experiments are rapidly expanding, providing new information about quantum materials on unprecedented length and time scales. Many such materials feature inhomogeneous electronic properties with intricate…

Strongly Correlated Electrons · Physics 2023-05-12 S. Basak , M. Alzate Banguero , L. Burzawa , F. Simmons , P. Salev , L. Aigouy , M. M. Qazilbash , I. K. Schuller , D. N. Basov , A. Zimmers , E. W. Carlson

Quantum kernels hold great promise for offering computational advantages over classical learners, with the effectiveness of these kernels closely tied to the design of the quantum feature map. However, the challenge of designing effective…

Quantum Physics · Physics 2024-01-23 Cong Lei , Yuxuan Du , Peng Mi , Jun Yu , Tongliang Liu

The classification of big data usually requires a mapping onto new data clusters which can then be processed by machine learning algorithms by means of more efficient and feasible linear separators. Recently, Lloyd et al. have advanced the…

We present a quantum feature-selection framework based on a higher-order unconstrained binary optimization (HUBO) formulation that explicitly incorporates multivariate dependencies beyond standard quadratic encodings. In contrast to…

The advent of hybrid computing platforms consisting of quantum processing units integrated with conventional high-performance computing brings new opportunities for algorithm design. By strategically offloading select portions of the…

A framework for statistical-mechanical analysis of quantum Hamiltonians is introduced. The approach is based upon a gradient flow equation in the space of Hamiltonians such that the eigenvectors of the initial Hamiltonian evolve toward…

Quantum Physics · Physics 2013-09-13 Dorje C. Brody , David C. P. Ellis , Darryl D. Holm

A central problem in open quantum systems is the characterization of non-Markovian processes, where an environment retains the memory of its interaction with the system. A key distinction is whether or not this memory can be simulated…

We introduce a counter-diabatic approach for deriving Hamiltonians modeling superchargable quantum batteries (QBs). A necessary requirement for the supercharging process is the existence of multipartite interactions among the cells of the…

Quantum Physics · Physics 2024-09-09 L. F. C. de Moraes , Alan C. Duriez , A. Saguia , Alan C. Santos , Marcelo S. Sarandy

Traditional machine learning applications, such as optical character recognition, arose from the inability to explicitly program a computer to perform a routine task. In this context, learning algorithms usually derive a model exclusively…

Quantum Physics · Physics 2020-05-14 Alex Wozniakowski , Jayne Thompson , Mile Gu , Felix Binder

We pursue the view that quantum theory may be an emergent structure related to large space-time scales. In particular, we consider classical Hamiltonian systems in which the intrinsic proper time evolution parameter is related through a…

General Relativity and Quantum Cosmology · Physics 2014-11-17 Hans-Thomas Elze

We show how to apply the quantum adiabatic algorithm directly to the quantum computation of molecular properties. We describe a procedure to map electronic structure Hamiltonians to 2-local qubit Hamiltonians with a small set of physically…

Quantum Physics · Physics 2015-02-20 Ryan Babbush , Peter J. Love , Alán Aspuru-Guzik

The controls enacting logical operations on quantum systems are described by time-dependent Hamiltonians that often include rapid oscillations. In order to accurately capture the resulting time dynamics in numerical simulations, a very…

Quantum Physics · Physics 2021-09-29 Ross Shillito , Jonathan A. Gross , Agustin Di Paolo , Élie Genois , Alexandre Blais

Diagonalizing a Hamiltonian, which is essential for simulating its long-time dynamics, is a key primitive in quantum computing and has been proven to yield a quantum advantage for several specific families of Hamiltonians. Yet, despite its…

Quantum Physics · Physics 2025-06-24 Taehee Ko , Sangkook Choi , Hyowon Park , Xiantao Li

Extracting Hamiltonian parameters from available experimental data is a challenge in quantum materials. In particular, real-space spectroscopy methods such as scanning tunneling spectroscopy allow probing electronic states with atomic…

Mesoscale and Nanoscale Physics · Physics 2024-01-23 Maryam Khosravian , Rouven Koch , Jose L. Lado

We address the nonadiabatic quantum dynamics of macrosystems with several coupled electronic states, taking into account the possibility of multi-state conical intersections. The general situation of an arbitrary number of states and…

Chemical Physics · Physics 2009-11-13 Etienne Gindensperger , Lorenz S. Cederbaum

We introduce several new quantum algorithms for estimating homological invariants, specifically Betti numbers and persistent Betti numbers, of a simplicial complex given via a structured classical input. At the core of our algorithm lies…

Quantum Physics · Physics 2026-04-28 Nhat A. Nghiem

We consider a solution to the problem of time in quantum gravity by deparameterisation of the ADM action in terms of York time, a parameter proportional to the extrinsic curvature of a spatial hypersurface. We study a minisuperspace model…

General Relativity and Quantum Cosmology · Physics 2014-12-16 Philipp Roser , Antony Valentini

We construct a simple translationally invariant, nearest-neighbor Hamiltonian on a chain of 10-dimensional qudits that makes it possible to realize universal quantum computing without any external control during the computational process.…

Quantum Physics · Physics 2009-11-13 Daniel Nagaj , Pawel Wocjan

Quantum computers are believed to bring computational advantages in simulating quantum many body systems. However, recent works have shown that classical machine learning algorithms are able to predict numerous properties of quantum systems…

Quantum Physics · Physics 2024-12-23 Riccardo Molteni , Casper Gyurik , Vedran Dunjko