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Related papers: Speeding up parallel tempering simulations

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We have introduced a variational method to improve the computation of integrated correlation times in the Parallel Tempering Dynamics, obtaining a better estimate (a lower bound, at least) of the exponential correlation time. Using this…

Disordered Systems and Neural Networks · Physics 2018-03-08 A. Billoire , L. A. Fernandez , A. Maiorano , E. Marinari , V. Martin-Mayor , J. Moreno-Gordo , G. Parisi , F. Ricci-Tersenghi , J. J. Ruiz-Lorenzo

We present an algorithm for the simulation of three-dimensional spin glasses deep in the low-temperature phase: Parallel Tempering enhanced with Houdayer moves and with an entropic reservoir (PTHR). Although differences with the standard…

Disordered Systems and Neural Networks · Physics 2026-05-26 Claudio Chilin , Enzo Marinari , Víctor Martín-Mayor , Giorgio Parisi , Juan J. Ruiz-Lorenzo , David Yllanes

The simulation of rare events is one of the key problems in atomistic simulations. Towards its solution a plethora of methods have been proposed. Here we combine two such methods metadynamics and inte-grated tempering sampling. In…

Chemical Physics · Physics 2018-10-29 Yi Isaac Yang , Haiyang Niu , Michele Parrinello

Simulating large scale lattice dynamics directly is computationally demanding due to the high complexity involved, yet such simulations are crucial for understanding the mechanical and thermal properties of many physical systems. In this…

Quantum Physics · Physics 2025-04-09 Xiantao Li

We develop a parallel rejection algorithm to tackle the problem of low acceptance in Monte Carlo methods, and apply it to the simulation of the hopping conduction in Coulomb glasses using Graphics Processing Units, for which we also…

Disordered Systems and Neural Networks · Physics 2014-08-19 Ezequiel E. Ferrero , Alejandro B. Kolton , Matteo Palassini

We present results from simulations of the gauge glass model in three dimensions using the parallel tempering Monte Carlo technique. Critical fluctuations should not affect the data since we equilibrate down to low temperatures, for…

Disordered Systems and Neural Networks · Physics 2007-05-23 Helmut G. Katzgraber , A. P. Young

Parallel tempering simulates at many quark masses simultaneously, by changing the mass during the simulation while remaining in equilibrium. The algorithm is faster than pure HMC if more than one mass is needed, and works better the smaller…

High Energy Physics - Lattice · Physics 2009-10-30 G. Boyd

Based on the particle-in-cell (PIC) plasma simulation method, the speed-limited PIC (SLPIC) method delivers faster kinetic plasma simulation in cases where the particle distributions evolve slowly compared with the maximum stable PIC…

Computational Physics · Physics 2019-01-09 Gregory R. Werner , Thomas G. Jenkins , Andrew M. Chap , John R. Cary

We study the dynamics of parallel tempering simulations, also known as the replica exchange technique, which has become the method of choice for simulation of proteins and other complex systems. Recent results for the optimal choice of the…

Statistical Mechanics · Physics 2009-11-13 Walter Nadler , Ulrich H. E. Hansmann

Large molecular dynamics simulations (millions of atoms, tens of microseconds, thousands of processors) hit the strong scalability wall: simulation on twice as many processors does not take half the time. Inspired by large N-body space…

Numerical Analysis · Computer Science 2013-10-21 Jana Pazúriková , Luděk Matyska

We have simulated, using parallel tempering, the three dimensional Ising spin glass model with binary couplings in a helicoidal geometry. The largest lattice (L=20) has been studied using a dedicated computer (the SUE machine). We have…

Disordered Systems and Neural Networks · Physics 2009-10-31 H. G. Ballesteros , A. Cruz , L. A. Fernandez , V. Martin-Mayor , J. Pech , J. J. Ruiz-Lorenzo , A. Tarancon , P. Tellez , C. L. Ullod , C. Ungil

Parallel tempering, also known as replica exchange sampling, is an important method for simulating complex systems. In this algorithm simulations are conducted in parallel at a series of temperatures, and the key feature of the algorithm is…

Probability · Mathematics 2012-06-14 Paul Dupuis , Yufei Liu , Nuria Plattner , J. D. Doll

We present details of our investigation of the Parallel Tempering algorithm. We consider the application of action matching technology to the selection of parameters. We then present a simple model of the autocorrelations for a particular…

High Energy Physics - Lattice · Physics 2009-10-31 Balint Joo , Alan C Irving , James C. Sexton , Brian Pendleton , Stephen M Pickles , Zbigniew Sroczynski , UKQCD Collaboration

We use computer simulations to study the dynamics of a physical gel at high densities where gelation and the glass transition interfere. We report and provide detailed physical understanding of complex relaxation patterns for time…

Soft Condensed Matter · Physics 2010-05-07 Pinaki Chaudhuri , Ludovic Berthier , Pablo I. Hurtado , Walter Kob

By means of parallel tempering Monte Carlo simulations we find strong evidence for a finite-temperature spin-glass transition in a system of diluted classical Heisenberg dipoles randomly placed on the sites of a simple cubic lattice. We…

Disordered Systems and Neural Networks · Physics 2009-12-18 Pawel Stasiak , Michel J. P. Gingras

Stochastic, spatial reaction-diffusion simulations have been widely used in systems biology and computational neuroscience. However, the increasing scale and complexity of simulated models and morphologies have exceeded the capacity of any…

Quantitative Methods · Quantitative Biology 2016-10-10 Weiliang Chen , Erik De Schutter

Numerical Simulation is an essential part of the design and optimisation of astronomical adaptive optics systems. Simulations of adaptive optics are computationally expensive and the problem scales rapidly with telescope aperture size, as…

Astrophysics · Physics 2009-11-13 A. G. Basden , F. Assemat , T. Butterley , D. Geng , C. D. Saunter , R. W. Wilson

A version of the time-parallel algorithm parareal is analyzed and applied to stochastic models in chemical kinetics. A fast predictor at the macroscopic scale (evaluated in serial) is available in the form of the usual reaction rate…

Numerical Analysis · Mathematics 2009-09-16 Stefan Engblom

Fast and accurate simulation of imaging through atmospheric turbulence is essential for developing turbulence mitigation algorithms. Recognizing the limitations of previous approaches, we introduce a new concept known as the phase-to-space…

Image and Video Processing · Electrical Eng. & Systems 2021-08-24 Zhiyuan Mao , Nicholas Chimitt , Stanley H. Chan

A number of improvements have been added to the existing analytical model of hysteresis loop defined in parametric form. In particular, three phase shifts are included in the model, which permits to tilt the hysteresis loop smoothly by the…

Optimization and Control · Mathematics 2020-06-11 Rostislav V. Lapshin