[Wien] problem with construction of supercell

Javad hashemifar jhashemifar at gmail.com
Thu Nov 16 09:14:10 CET 2006


hello
except for special cases and high symmetry supercells the selected
"target lattice type" should be P. Try with this option and see
whether your problem exist or not ?

best regards
SJ Hashemifar

On 11/15/06, Benali Ben <kanoun_benali at yahoo.fr> wrote:
> Dear Users:
> I have tried to construct a supercell of W with a structure bcc
> I have increased the cell size by 2*2*2 and with F (Enter your target
> lattice type) group symmetry but I have problem with the number of the atoms
> what is the solution, what's kind of symmetry group must I consider in order
> to have a correct supercell
>
>  thank you for helping me.
>
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Javad Hashemifar, Ph.D. student
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Physics Department, Isfahan University of Technology, 84156, Isfahan, Iran
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