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The Mori-Zwanzig formalism of statistical mechanics is used to estimate the uncertainty caused by underresolution in the solution of a nonlinear dynamical system. A general approach is outlined and applied to a simple example. The noise…

数值分析 · 数学 2013-06-14 Alexandre J. Chorin , Ole H. Hald

We present a new method to approximate the Mori-Zwanzig (MZ) memory integral in generalized Langevin equations (GLEs) describing the evolution of smooth observables in high-dimensional nonlinear systems with local interactions. Building…

数值分析 · 数学 2020-03-18 Yuanran Zhu , Daniele Venturi

The Mori-Zwanzig formalism is a powerful theoretical framework for deriving equations of motion for coarse-grained observables in the form of generalized Langevin equations (GLEs) involving evolution and projection operators. Using a…

We introduce a new method to accurately and efficiently estimate the effective dynamics of collective variables in molecular simulations. Such reduced dynamics play an essential role in the study of a broad class of processes, ranging from…

Understanding, predicting and controlling laminar-turbulent boundary-layer transition is crucial for the next generation aircraft design. However, in real flight experiments, or wind tunnel tests, often only sparse sensor measurements can…

Coarse-grained (CG) models are simplified representations of soft matter systems that are commonly employed to overcome size and time limitations in computational studies. Many approaches have been developed to construct and parametrise…

统计力学 · 物理学 2022-09-27 Piero Luchi , Roberto Menichetti , Gianluca Lattanzi , Raffaello Potestio

We present a microscopic derivation of the laws of continuum mechanics of nonideal ordered solids including dissipation, defect diffusion, and heat transport. Starting point is the classical many-body Hamiltonian. The approach relies on the…

统计力学 · 物理学 2022-11-23 Florian Miserez , Saswati Ganguly , Rudolf Haussmann , Matthias Fuchs

In this paper we consider the problem of deriving approximate autonomous dynamics for a number of variables of a dynamical system, which are weakly coupled to the remaining variables. In a previous paper we have used the Ruelle response…

统计力学 · 物理学 2015-06-11 Jeroen Wouters , Valerio Lucarini

We develop rigorous estimates and provably convergent approximations for the memory integral in the Mori-Zwanzig (MZ) formulation. The new theory is built upon rigorous mathematical foundations and is presented for both state-space and…

数值分析 · 数学 2018-10-17 Yuanran Zhu , Jason M. Dominy , Daniele Venturi

Using a generalized Langevin equation of motion, quantum ballistic thermal transport is obtained from classical molecular dynamics. This is possible because the heat baths are represented by random noises obeying quantum Bose-Einstein…

统计力学 · 物理学 2007-10-16 Jian-Sheng Wang

The classical work by Zwanzig [J. Stat. Phys. 9 (1973) 215-220] derived Langevin dynamics from a Hamiltonian system of a heavy particle coupled to a heat bath. This work extends Zwanzig's model to a quantum system and formulates a more…

数学物理 · 物理学 2019-06-25 Håkon Hoel , Anders Szepessy

The underdamped, non-linear, generalized Langevin equation is widely used to model coarse-grained dynamics of soft and biological materials. By means of a projection operator formalism, we show under which approximations this equation can…

软凝聚态物质 · 物理学 2022-02-04 Fabian Glatzel , Tanja Schilling

Reduced models for the (defocusing) nonlinear Schr\"odinger equation are developed. In particular, we develop reduced models that only involve the low-frequency modes given noisy observations of these modes. The ansatz of the reduced…

统计力学 · 物理学 2015-05-25 John Harlim , Xiantao Li

We present a derivation of a coarse-grained model from the Langevin dynamics. The focus is placed on the memory kernel function and the fluctuation-dissipation theorem. Also presented is an hierarchy of approximations for the memory and…

数值分析 · 数学 2019-10-04 Lina Ma , Xiantao Li , Chun Liu

The Zwanzig-Mori pro jection formalism is widely used in studying systems with many degrees of freedom. Recently Xing and Kim used the pro jection formalism and derived the generalized Langevin equations (GLEs) for a general stochastic…

统计力学 · 物理学 2013-04-18 Abhishek Mukhopadhyay , Jianhua Xing

The systematic development of Coarse-Grained (CG) models via the Mori-Zwanzig projector operator formalism requires the explicit description of several terms, including a deterministic drift term, a dissipative memory term and a random…

统计力学 · 物理学 2021-09-29 N. Di Pasquale , T. Hudson , M. Icardi , L. Rovigatti , M. Spinaci

This paper has two interrelated foci: (i) obtaining stable and efficient data-driven closure models by using a multivariate time series of partial observations from a large-dimensional system; and (ii) comparing these closure models with…

概率论 · 数学 2015-06-23 Dmitri Kondrashov , Mickaël D. Chekroun , Michael Ghil

We show that vertex corrections to the quasi-harmonic Green-Kubo theory of heat transport in insulators naturally lead to a generalisation of the expression for the conductivity that could be derived from the linearized Boltzmann equation,…

统计力学 · 物理学 2023-03-08 Alfredo Fiorentino , Stefano Baroni

Energy-transport equations for the transport of fermions in optical lattices are formally derived from a Boltzmann transport equation with a periodic lattice potential in the diffusive limit. The limit model possesses a formal gradient-flow…

偏微分方程分析 · 数学 2017-04-11 Marcel Braukhoff , Ansgar Jüngel

The Mori-Zwanzig projection formalism is widely used in studying systems with many degrees of freedom. We used a system-bath Hamiltonian system to show that the Mori's and Zwanzig's projection procedures are mutual limiting cases of each…

统计力学 · 物理学 2009-04-20 Jianhua Xing