Strong-field physics using TDCIS

ORAL

Abstract

We present an implementation of the time-dependent configuration interaction singles (TDCIS) method for treating atomic strong-field processes. In order to remove the photoelectron wave packet at the end of the spatial grid, we add to the nonrelativistic many-electron Hamiltonian a radial complex absorbing potential (CAP). We determine orbitals by diagonalizing the sum of the Fock operator and the CAP using a radial pseudo-spectral grid combined with spherical harmonics. The CAP is chosen such that the occupied orbitals in the Hartree-Fock ground state remain unaffected. The virtual orbitals satisfy non-standard orthogonality relations, which affects the calculation of the dipole and Coulomb matrix elements required. We propagate the TDCIS equations of motion by second-order finite differencing in the interaction picture and transformation to the Schr\"{o}dinger picture.

*This work was supported by the Office of Basic Energy Sciences, Office of Science, U.S. Department of Energy, under Contract No. DE-AC02-06CH11357.

Authors

  • Phay Ho

    • Argonne National Laboratory
    • Argonne National Laboratory, Argonne, Illinois 60439, USA
  • Loren Greenman

    • University of Chicago
  • Eugene Kamarchik

    • University of Chicago
  • David Mazziotti

    • University of Chicago
  • Robin Santra

    • Argonne National Laboratory and University of Chicago