[xcrysden] Xcrysden 1.5.53

[Tone Kokalj]

On Wed, 2013-04-24 at 15:34 +0000, Zhu, Jianxin wrote:
> Hi Tone, 
> 
> I figured out the problem. The issue is not due to version 1.5.53 versus
> 1.5.24. 
> I tested with the version 1.5.53 on my macbook, the generated k-path is
> correct. 
> The problem lies in that the version 1.5.53 on my linux box sets the value
> of M (M*kx,M*ky,M*kz) to be 1 (rather than values like 4 for fcc Gamma -->
> L --> W --> X --> Gamma as appropriately given on my macbook), which
> causes the error. For this, I have manually correct M to be 4 and those
> values of (M*kx,M*ky,M*kz) and then the generated k-path is identical to
> those on my Mac OSX machines.
> 
> But I don't know why M is set to be 1 on my linux machine.

Neither do I; but there is the possibility to set it manually as you
did!

Regards,
-- 
Anton Kokalj
J. Stefan Institute, Jamova 39, 1000 Ljubljana, Slovenia 
(tel: +386-1-477-3523 // fax:+386-1-477-3822)

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