4.6 Article

Self-learning Monte Carlo method

期刊

PHYSICAL REVIEW B
卷 95, 期 4, 页码 -

出版社

AMER PHYSICAL SOC
DOI: 10.1103/PhysRevB.95.041101

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资金

  1. DOE Office of Basic Energy Sciences, Division of Materials Sciences and Engineering [DE-SC0010526]
  2. David and Lucile Packard Foundation
  3. Ministry of Science and Technology (MOST) of China [2016YFA0300502]
  4. National Natural Science Foundation of China (NSFC) [11421092, 11574359]
  5. National Thousand-Young-Talents Program of China

向作者/读者索取更多资源

Monte Carlo simulation is an unbiased numerical tool for studying classical and quantum many-body systems. One of its bottlenecks is the lack of a general and efficient update algorithm for large size systems close to the phase transition, for which local updates perform badly. In this Rapid Communication, we propose a general-purpose Monte Carlo method, dubbed self-learning Monte Carlo (SLMC), in which an efficient update algorithm is first learned from the training data generated in trial simulations and then used to speed up the actual simulation. We demonstrate the efficiency of SLMC in a spin model at the phase transition point, achieving a 10-20 times speedup.

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