- ...size',
- The step size is chosen so that the acceptance ratio
(
) is approximately 16#16, as this has been shown
[3] to give the maximum computational efficiency.
- ...determinants
- It can be shown that as the Hamiltonian does not include
spin coordinates, the expectation value of the energy is the same when
using (
) as when using a full Slater determinant in the
trial wavefunction.
Andrew Williamson
Mon May 22 14:48:37 BST 1995