Dear Bob,
Just a question. I got to work the procedure to append a new atom to
structure with the command
set appendNew FALSE; DATA "append"1 S 0.1 0.1 1 end "append" .... Now This
procedure works fine for the first entry. Whenever i Try to enter a 2nd and
3rd atom with the same command line (of course different coordinates), the
cell of the crystal structure disappear. How come ? Can you try?
It would be nice entering atoms in different time not all in one shot as
explained in the online guide
*data "model example"
2
testing
C 1 1 1
O 2 2 2
end "model example";show data*
Thanks, Piero
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Pieremanuele Canepa
Room 104
Functional Material Group
School of Physical Sciences, Ingram Building,
University of Kent, Canterbury, Kent,
CT2 7NH
United Kingdom
e-mail: pc...@kent.ac.uk
mobile: +44 (0) 7772-9756456
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