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THE RANDOM BATCH METHOD for N-BODY QUANTUM DYNAMICS*

  • Shanghai Jiao Tong University
  • Sorbonne Université

Résultats de recherche: Contribution à un journalArticleRevue par des pairs

Résumé

This paper discusses a numerical method for computing the evolution of large interacting system of quantum particles. The idea of the random batch method is to replace the total interaction of each particle with the N −1 other particles by the interaction with p ≪ N particles chosen at random at each time step, multiplied by (N − 1)/p. This reduces the computational cost of computing the interaction potential per time step from O(N2) to O(N). For simplicity, we consider only in this work the case p = 1 — in other words, we assume that N is even, and that at each time step, the N particles are organized in N/2 pairs, with a random reshuffling of the pairs at the beginning of each time step. We obtain a convergence estimate for the Wigner transform of the single-particle reduced density matrix of the particle system at time t that is both uniform in N > 1 and independent of the Planck constant h̵. The key idea is to use a new type of distance on the set of quantum states that is reminiscent of the Wasserstein distance of exponent 1 (or Monge-Kantorovich-Rubinstein distance) on the set of Borel probability measures on Rd used in the context of optimal transport. Mathematics subject classification: 82C10, 82C22 (65M75).

langue originaleAnglais
Pages (de - à)897-922
Nombre de pages26
journalJournal of Computational Mathematics
Volume39
Numéro de publication6
Les DOIs
étatPublié - 1 janv. 2021

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