[Octopus-notify] svn commit: r2361 - trunk/src by appel
octopus-notify at tddft.org
octopus-notify at tddft.org
Sat Aug 12 21:24:26 WEST 2006
Author: appel
Date: Sat Aug 12 21:24:24 2006
New Revision: 2361
Changeset: http://www.tddft.org/trac/octopus/changeset/2361
Modified:
trunk/src/scf.F90
trunk/src/states.F90
trunk/src/states_inc.F90
trunk/src/unocc.F90
Log:
o Add routine to compute the degeneracy matrix for scattering
states.
o Add option to choose between scaled and unscaled k-vectors
for the output of bands.
o Fix a couple of cases which were not MPI clean.
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