• Title of article

    A Gaussian wavepacket approach for including correlation in the time-dependent Hartree wavefunction for short times

  • Author/Authors

    Adams، نويسنده , , James W. and Poovey Jr.، نويسنده , , Richard A. and Messina، نويسنده , , Michael، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 1999
  • Pages
    9
  • From page
    266
  • To page
    274
  • Abstract
    A hybrid Gaussian wavepacket time-dependent Hartree approach to quantum dynamics is presented. The time-dependent Hartree method yields an efficient methodology for solving the multi-dimensional time-dependent Schrِdinger equation, but has the deficiency of enforcing a factorized form of the wavepacket for all time. We present a strategy for including the correlations in the time-dependent Hartree wavefunction by including a time-dependent correction to the Hartree wavefunction. This correction has the form of a time-dependent Gaussian wavepacket. We test the hybrid Gaussian wavepacket-time-dependent Hartree approach and find that it is able to predict correlations in the wavefunctions for at least a single vibrational period.
  • Journal title
    Chemical Physics Letters
  • Serial Year
    1999
  • Journal title
    Chemical Physics Letters
  • Record number

    1780540