[Octopus-notify] svn commit: r5691 - in trunk: testsuite/open_systems by nitsche

[octopus-notify at tddft.org]

      Author: nitsche
        Date: Mon Jul  6 22:21:13 2009
New Revision: 5691
   Changeset: http://www.tddft.org/trac/octopus/changeset/5691

Modified:
   trunk/src/states/states.F90
   trunk/testsuite/open_systems/03-extended_eigenstate.01-square_well_1d.inp
   trunk/testsuite/open_systems/03-extended_eigenstate.02-ring_leads_2d.inp
   trunk/testsuite/open_systems/04-propagate_eigenstate.01-square_well_1d.inp
   trunk/testsuite/open_systems/04-propagate_eigenstate.02-ring_leads_2d.inp
   trunk/testsuite/open_systems/04-propagate_eigenstate.test

Log:
* if parallel in k-points the initial random wavefunctions are also have as the seed the rank
* the lopcg solver seems to have some problems with the square potential, so changed all open boundary tests to cg_new, which seems to work right now
* problem of the failing test was the random initial wavefunction, had to change the final tolerance