[Wien] density plots for NiO

[Oscar Restrepo]

Dear WIEN users:

I am trying to plot the charge density distribution in the (100) and the
(111) planes for AFM NiO but I am having a hard time figuring out the
correct specifications for ix,iy, and iz, in the file *.in5, for the x-end
and the y-end.

Are these coordinates supposed to be given in units of the rhombohedral
lattice vectors or in units of the hexagonal lattice vectors , or in terms
of an orthogonal basis that has the c axis pointing along the (111)
direction in the conventional (cubic) unit cell ?

I have tried to use the program rhomb_in5 but for some reason it does not do
anything after I enter the  3 trigonal coordinates.

Thanks in advance,

Oscar.

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Oscar D. Restrepo
Department of Physics and Astronomy
The University of Tennessee
1408 Circle Drive
Knoxville, Tennessee 37996-1200
Phone: (865) 974-9883
Fax: (865) 974-7843

and

Condensed Matter Sciences Division
Oak Ridge National Laboratory
P.O.Box 2008
Oak Ridge, TN 37831-6032
Phone: (865) 574-5232
Fax: (865)574-4143
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