[Octopus-devel] spglib output
Xavier Andrade
xavier at tddft.org
Fri Mar 6 06:32:52 WET 2009
Oops, sorry. I will check it.
X
On Thu, 5 Mar 2009, David Strubbe wrote:
> Additionally, it seems to me that the default of gamma point when no
> k-points are specified has disappeared. My calculation (relying on this
> default) was just running with some unknown undefined k-point, which
> appeared neither in the output file nor the exec/out.oct file.
>
> On Thu, Mar 5, 2009 at 7:05 PM, David Strubbe <dstrubbe at berkeley.edu> wrote:
> Also I get weird control characters in the output after the
> point group:
>
> Space group No.25
> International: Pm m 2
> International(long): Pm m 2
> Schoenflies: C2v^1
> Multiplicity: 4
> Point group
> International: m m 2
> Schoenflies: C2v- Show quoted text -
>
>
> On Thu, Mar 5, 2009 at 6:54 PM, David Strubbe <dstrubbe at berkeley.edu>
> wrote:
> Can we make the analysis of the space group and point
> group be printed only by node 0? Currently it is being
> printed by every node.
>
> David
>
>
>
>
>
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