Diffusion Monte Carlo methods with a fixed number of walkers

被引:65
作者
Assaraf, R
Caffarel, M
Khelif, A
机构
[1] Univ Paris 06, CNRS, Chim Theor Lab, F-75252 Paris, France
[2] Univ Denis Diderot, Lab Log Math, CNRS, F-75251 Paris, France
来源
PHYSICAL REVIEW E | 2000年 / 61卷 / 04期
关键词
D O I
10.1103/PhysRevE.61.4566
中图分类号
O35 [流体力学]; O53 [等离子体物理学];
学科分类号
070204 ; 080103 ; 080704 ;
摘要
In this paper we discuss various aspects of diffusion Monte Carlo methods using a fixed number of walkers. First, a rigorous proof of the divergence of pure diffusion Monte Carlo (PDMC) methods (DMC without branching in which the weights are carried along trajectories) is given. Second, a bias-free Monte Carlo method combining DMC and PDMC approaches, and based on a minimal stochastic reconfiguration of the population, is discussed. Finally, some illustrative calculations for a system of coupled quantum rotators are presented.
引用
收藏
页码:4566 / 4575
页数:10
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