[CPMD-list] LSD calculation

BOUYER Frédéric 153746 FB153746 at atil.cea.fr
Thu Sep 2 11:09:22 CEST 2004


Dear CPMD users,
 
Calculating oxygen (1 atom) in a box with and without LSD keyword gives me
the same energy. It looks strange to me.
Anybody could help me to understand and to overcome this problem?
 
Frédéric Bouyer
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