Difference in energy between numerical orbitals and analytic orbitals versus grid size

These data indicate that representing the QMC orbitals on a grid with a spacing of 4 grid points per Angstrom is in good agreement with using analytic orbitals.

More details of the analysis of numerical orbitals



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<http://www.physics.ohio-state.edu/~wilkins/group/qmc/data/numorb_study.html>
[Friday, 25-May-2012 18:44:16 EDT]
Edited by: wilkins@mps.ohio-state.edu on Monday, 06-Dec-2004 13:26:02 EST