[Octopus-users] Periodic Boundary Conditions.
juzar18 at gmail.com
Tue Sep 30 12:33:34 WEST 2008
Dear Octopus User's,
Hi I have just started using octopus and am having some problems with
some basic concepts. Can we assign a super cell size in octopus.?
Eg: In VASP we can give a cell size much larger than the dimensions of
This is generally done to avoid periodic boundary conditions. Like in
the case of small clusters. Does OCTOPUS have any such arrangements.
If not how do I deal with clusters without periodic boundary
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