English

Autoregressive neural Slater-Jastrow ansatz for variational Monte Carlo simulation

Strongly Correlated Electrons 2023-06-22 v4

Abstract

Direct sampling from a Slater determinant is combined with an autoregressive deep neural network as a Jastrow factor into a fully autoregressive Slater-Jastrow ansatz for variational quantum Monte Carlo, which allows for uncorrelated sampling. The elimination of the autocorrelation time leads to a stochastic algorithm with provable cubic scaling (with a potentially large prefactor), i.e. the number of operations for producing an uncorrelated sample and for calculating the local energy scales like O(Ns3)\mathcal{O}(N_s^3) with the number of orbitals NsN_s. The implementation is benchmarked on the two-dimensional tVt-V model of spinless fermions on the square lattice.

Keywords

Cite

@article{arxiv.2210.05871,
  title  = {Autoregressive neural Slater-Jastrow ansatz for variational Monte Carlo simulation},
  author = {Stephan Humeniuk and Yuan Wan and Lei Wang},
  journal= {arXiv preprint arXiv:2210.05871},
  year   = {2023}
}

Comments

60 pages; Submission to SciPost