Literature DB >> 16483198

Acceleration of Markov chain Monte Carlo simulations through sequential updating.

Ruichao Ren1, G Orkoulas.   

Abstract

Strict detailed balance is not necessary for Markov chain Monte Carlo simulations to converge to the correct equilibrium distribution. In this work, we propose a new algorithm which only satisfies the weaker balance condition, and it is shown analytically to have better mobility over the phase space than the Metropolis algorithm satisfying strict detailed balance. The new algorithm employs sequential updating and yields better sampling statistics than the Metropolis algorithm with random updating. We illustrate the efficiency of the new algorithm on the two-dimensional Ising model. The algorithm is shown to identify the correct equilibrium distribution and to converge faster than the Metropolis algorithm with strict detailed balance. The main advantages of the new algorithm are its simplicity and the feasibility of parallel implementation through domain decomposition.

Year:  2006        PMID: 16483198     DOI: 10.1063/1.2168455

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  1 in total

1.  Parallel Prefetching for Canonical Ensemble Monte Carlo Simulations.

Authors:  Harold W Hatch
Journal:  J Phys Chem A       Date:  2020-08-25       Impact factor: 2.781

  1 in total

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