English

Quantum Monte Carlo estimation of complex-time correlations for the study of the ground-state dynamic structure function

Statistical Mechanics 2015-06-24 v1

Abstract

We present a method based on the Path Integral Monte Carlo formalism for the calculation of ground-state time correlation functions in quantum systems. The key point of the method is the consideration of time as a complex variable whose phase δ\delta acts as an adjustable parameter. By using high-order approximations for the quantum propagator, it is possible to obtain Monte Carlo data all the way from purely imaginary time to δ\delta values near the limit of real time. As a consequence, it is possible to infer accurately the spectral functions using simple inversion algorithms. We test this approach in the calculation of the dynamic structure function S(q,ω)S(q,\omega) of two one-dimensional model systems, harmonic and quartic oscillators, for which S(q,ω)S(q,\omega) can be exactly calculated. We notice a clear improvement in the calculation of the dynamic response with respect to the common approach based on the inverse Laplace transform of the imaginary-time correlation function.

Keywords

Cite

@article{arxiv.1503.01399,
  title  = {Quantum Monte Carlo estimation of complex-time correlations for the study of the ground-state dynamic structure function},
  author = {Riccardo Rota and Joaquim Casulleras and Ferran Mazzanti and Jordi Boronat},
  journal= {arXiv preprint arXiv:1503.01399},
  year   = {2015}
}

Comments

Accepted for publication on "Jornal of Chemical Physics"

R2 v1 2026-06-22T08:44:28.660Z