.
HTH
Stefan
--
Stefan Löffler USTEM
Vienna University of Technology T: +43 1 58801-45226
Wiedner Hauptstraße 8-10/E052 / A-1040 Wien F: +43 1 58801-13899
http://tinyurl.com/njcu47
: if a proposed struct file is
accepted, any existing case.inst file should me renamed (or removed), as
it might include spin configurations for atoms that are no longer part
of the struct file (e.g., due to changed equivalencies).
Kind regards,
Stefan Löffler
--
Stefan Löffler
Dear list,
over the last couple of weeks and months, I found a few minor problems
and/or inconveniences, in particular in connection with w2web. Attached
are fixes for most of them.
*) SRC_w2web/htdocs/usersguide is a symlink to
/area51/WIEN2k_11/SRC_usersguide_html, which I guess on most
Hi,
On 2012-06-21 19:40, Lucy Kiruri wrote:
3) s = loadstruct(Pb.struct)
This is the wrong approach as it doesn't take Pb.struct as a
string/filename but as a variable.
I also tried s=loadstruct(Pb2.struct)
This is the correct approach (BTW: why do you have Pb.struct above,
and Pb2.struct
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