[Pw_forum] input file for isolated atom
Paolo Giannozzi
giannozz at democritos.it
Fri Sep 11 13:44:13 CEST 2009
On Sep 11, 2009, at 10:36 , Prasenjit Ghosh wrote:
> (a) while doing calculations for any zero dimensions
> you should always set nosym =.true.
for Gamma-point calculations it shouldn't make any
difference
P.
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Paolo Giannozzi, Dept of Physics, University of Udine
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