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The Weyl-Wigner representation of quantum mechanics allows one to map the density operator in a function in phase space - the Wigner function - which acts like a probability distribution. In the context of statistical mechanics, this…

量子物理 · 物理学 2023-08-31 Marcos Gil de Oliveira , Alfredo Miguel Ozorio de Almeida

Quantum computers hold promise to enable efficient simulations of the properties of molecules and materials; however, at present they only permit ab initio calculations of a few atoms, due to a limited number of qubits. In order to harness…

材料科学 · 物理学 2020-07-07 He Ma , Marco Govoni , Giulia Galli

In this work, we apply a semi-Lagrangian spectral method for the Vlasov-Poisson system, previously designed for periodic Fourier discretizations, by implementing Legendre polynomials and Hermite functions in the approximation of the…

数值分析 · 数学 2018-07-09 Lorella Fatone , Daniele Funaro , Gianmarco Manzini

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,…

量子物理 · 物理学 2016-10-25 Nicholas C. Rubin

Classical-like formulas are given in order to evaluate thermal averages of observables belonging to a quantum nonlinear system with dissipation described by the Caldeira-Leggett model [Phys. Rev. Lett. 46, 211 (1981); Ann. Phys. (N.Y.) 149,…

统计力学 · 物理学 2009-10-30 Alessandro Cuccoli , Andrea Rossi , Valerio Tognetti , Ruggero Vaia

Hybrid classical-quantum algorithms aim at variationally solving optimisation problems, using a feedback loop between a classical computer and a quantum co-processor, while benefitting from quantum resources. Here we present experiments…

We assess the suitability of quantum and semiclassical initial value representations, exemplified by the coupled coherent states (CCS) method and the Herman Kluk (HK) propagator, respectively, for modeling the dynamics of an electronic wave…

原子物理 · 物理学 2015-06-19 C. Zagoya , J. Wu , M. Ronto , D. V. Shalashilin , C. Figueira de Morisson Faria

Accurate predictions of inclusive scattering cross sections in the linear response regime require efficient and controllable methods to calculate the spectral density in a strongly-correlated many-body system. In this work we reformulate…

量子物理 · 物理学 2023-03-29 Jeremy Hartse , Alessandro Roggero

Spectroscopy is an indispensable tool in understanding the structures and dynamics of molecular systems. However computational modelling of spectroscopy is challenging due to the exponential scaling of computational complexity with system…

量子物理 · 物理学 2021-06-22 Chee-Kong Lee , Chang-Yu Hsieh , Shengyu Zhang , Liang Shi

Using a recently introduced tensor network method, we study the density of states of the lattice Schwinger model, a standard testbench for lattice gauge theory numerical techniques, but also the object of recent experimental quantum…

高能物理 - 格点 · 物理学 2021-08-04 Irene Papaefstathiou , Daniel Robaina , J. Ignacio Cirac , Mari Carmen Bañuls

Thermalization of a system in the presence of a heat bath has been the subject of many theoretical investigations especially in the framework of solid-state physics. In this setting, the presence of a large bandwidth for the frequency…

统计力学 · 物理学 2015-10-09 Roberto Onofrio , Bala Sundaram

A framework for simulating the real-time dynamics of composite particles in a simple model of dense matter that is amenable to quantum computers is developed. As a demonstration, we perform classical simulations of heavy-hadrons propagating…

量子物理 · 物理学 2025-01-22 Roland C. Farrell , Marc Illa , Martin J. Savage

This work presents an efficient numerical method to evaluate the free energy density and associated thermodynamic quantities of (quasi) one-dimensional classical systems, by combining the transfer operator approach with a numerical…

数值分析 · 数学 2021-03-09 Christian B. Mendl , Folkmar Bornemann

We propose computationally efficient methods for estimating stationary multivariate spatial and spatial-temporal spectra from incomplete gridded data. The methods are iterative and rely on successive imputation of data and updating of model…

统计方法学 · 统计学 2018-11-06 Joseph Guinness

We propose a hybrid quantum-classical eigensolver to address the computational challenges of simulating strongly correlated quantum many-body systems, where the exponential growth of the Hilbert space and extensive entanglement render…

量子物理 · 物理学 2025-10-23 Lei Xu , Ling Wang

The development of emerging technologies in quantum optics demands accurate models that faithfully capture genuine quantum effects. Mature semiclassical approaches reach their limits when confronted with quantized electromagnetic fields,…

Developing efficient path integral (PI) methods for atomistic simulations of vibrational spectra in heterogeneous condensed phases and interfaces has long been a challenging task. Here, we present the h-CMD method, short for hybrid centroid…

化学物理 · 物理学 2025-05-08 Dil K. Limbu , Nathan London , Md Omar Faruque , Mohammad R. Momeni

Owing to the computational complexity of electronic structure algorithms running on classical digital computers, the range of molecular systems amenable to simulation remains tightly circumscribed even after many decades of work. Quantum…

量子物理 · 物理学 2022-05-18 Alexis Ralli , Michael I. Williams , Peter V. Coveney

Several UV complete models of physics beyond the Standard Model are currently under scrutiny, their low-energy dynamics being compared with the experimental data from the LHC. Lattice simulations can play a role in these studies by…

高能物理 - 格点 · 物理学 2017-02-20 Luigi Del Debbio , Christoph Englert , Roman Zwicky

Estimating transition rates in open quantum systems is hampered by computing-resource demands that grow rapidly with system size. We present a quantum-simulation framework that enables efficient estimation by recasting the transition rate,…

量子物理 · 物理学 2025-12-16 Robson Christie , Kyunghyun Baek , Jeongho Bang , Jaewoo Joo