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Title: Application of Coulomb wave function discrete variable representation to atomic systems in strong laser fields

Journal Article · · Journal of Chemical Physics
DOI:https://doi.org/10.1063/1.2358351· OSTI ID:20864319
;  [1]
  1. Department of Physics and Astronomy, The University of Nebraska-Lincoln, Nebraska 68588-0111 (United States)

We present an efficient and accurate grid method for solving the time-dependent Schroedinger equation for an atomic system interacting with an intense laser pulse. Instead of the usual finite difference (FD) method, the radial coordinate is discretized using the discrete variable representation (DVR) constructed from Coulomb wave functions. For an accurate description of the ionization dynamics of atomic systems, the Coulomb wave function discrete variable representation (CWDVR) method needs three to ten times fewer grid points than the FD method. The resultant grid points of the CWDVR are distributed unevenly so that one has a finer grid near the origin and a coarser one at larger distances. The other important advantage of the CWDVR method is that it treats the Coulomb singularity accurately and gives a good representation of continuum wave functions. The time propagation of the wave function is implemented using the well-known Arnoldi method. As examples, the present method is applied to multiphoton ionization of both the H atom and the H{sup -} ion in intense laser fields. The short-time excitation and ionization dynamics of H by an abruptly introduced static electric field is also investigated. For a wide range of field parameters, ionization rates calculated using the present method are in excellent agreement with those from other accurate theoretical calculations.

OSTI ID:
20864319
Journal Information:
Journal of Chemical Physics, Vol. 125, Issue 15; Other Information: DOI: 10.1063/1.2358351; (c) 2006 American Institute of Physics; Country of input: International Atomic Energy Agency (IAEA); ISSN 0021-9606
Country of Publication:
United States
Language:
English