version=12.1.14_dev

# new feature: load SUPERCELL "2x, x+y, 2z"
#              load SUPERCELL "{2 2 2}"
#              load {20 20 2} SUPERCELL "{2 2 2}"

hey, this is actually VERY FUN!

On Fri, Sep 17, 2010 at 2:04 AM, P.Canepa <pc229@kent.ac.uk> wrote:
Dear all,
could be possible to add an option to re-set the dimensions of the cell once you the original cell is manipulated?
 
For instance load "" { 2 2 2} ; the command could be setSupercell ?
 
So then when the structure is esported both the coordinate and the cell parameters are correctely exported.
 
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: pc229@kent.ac.uk
mobile: +44 (0) 7772-9756456
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