VMD-L Mailing List

From: John Stone (johns_at_ks.uiuc.edu)
Date: Thu Feb 07 2013 - 09:05:29 CST

Hi,
  If you send me an input file that reproduces the problem, I will
take a look at it and see what I can find out. VMD has definitely
displayed non-orthorhombic density maps correctly in the past, so
this might be specific to something with the VASP reader plugin.

Cheers,
  John Stone
  vmd_at_ks.uiuc.edu

On Thu, Feb 07, 2013 at 03:55:52PM +0100, Torsten Kerber wrote:
> i have loaded a CHGCAR (VASP) for a non-orthorhombic cell (alpha =
> beta = gamma = 60 deg).
> Showing the isosurface as POINTS works well.
> However, when I switch to WIREFRAMES or SOLID SURFACES, the isosurface
> is shown at a "wrong position".
>
> The error does not occur in case of orthorhombic unit cells.
>
> Best regards,
>
> Torsten KERBER
>
> --
> office: +33 4 37 70| 29 85 

-- 
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