[Wien] k-point sampling: clarification

[L. D. Marks]

N.B. I mean the kx,kz sampling -- I only have one point along ky
(surface).

On Sat, 26 Jun 2004, L. D. Marks wrote:

> I'm trying to do a couple of calculations where I want to keep consistency
> between the k-points. One is in P2/m (#10), the other in B2/m (#12). In
> P2/m the grid generated by kgen is a rectangle; in B2/m it is a triangle.
> I must be missing something; in B2/m is the grid in terms of the primitive
> cell or what?
>
> -----------------------------------------------
> Laurence Marks
> Department of Materials Science and Engineering
> MSE Rm 2036 Cook Hall
> 2225 N Campus Drive
> Northwestern University
> Evanston, IL 60201, USA
> Tel: (847) 491-3996 Fax: (847) 491-7820
> mailto:L-marks at northwestern.edu
> http://www.numis.northwestern.edu
> -----------------------------------------------
>
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-----------------------------------------------
Laurence Marks
Department of Materials Science and Engineering
MSE Rm 2036 Cook Hall
2225 N Campus Drive
Northwestern University
Evanston, IL 60201, USA
Tel: (847) 491-3996 Fax: (847) 491-7820
mailto:L-marks at northwestern.edu
http://www.numis.northwestern.edu
-----------------------------------------------