4.5 Article

On the Convergence of Time Splitting Methods for Quantum Dynamics in the Semiclassical Regime

Journal

FOUNDATIONS OF COMPUTATIONAL MATHEMATICS
Volume 21, Issue 3, Pages 613-647

Publisher

SPRINGER
DOI: 10.1007/s10208-020-09470-z

Keywords

Evolutionary equations; Time-dependent Schrodinger equations; Exponential operator splitting methods; Wasserstein distance

Funding

  1. LIA LYSM (AMU)
  2. LIA LYSM (CNRS)
  3. LIA LYSM (ECM)
  4. LIA LYSM (INdAM)
  5. NSFC [31571071, 11871297]

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The research demonstrates the uniform convergence of time splitting algorithms for the von Neumann equation of quantum dynamics in the Planck constant h, and provides explicit error estimates uniform in h for the first-order Lie-Trotter and second-order Strang splitting methods.
By using the pseudo-metric introduced in Golse and Paul (Arch Ration Mech Anal 223:57-94, 2017), which is an analogue of the Wasserstein distance of exponent 2 between a quantum density operator and a classical (phase-space) density, we prove that the convergence of time splitting algorithms for the von Neumann equation of quantum dynamics is uniform in the Planck constant h. We obtain explicit uniform in h error estimates for the first-order Lie-Trotter, and the second-order Strang splitting methods.

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