VMD-L Mailing List

From: Axel Kohlmeyer (akohlmey_at_gmail.com)
Date: Wed Apr 06 2022 - 05:48:26 CDT

On Wed, Apr 6, 2022 at 4:00 AM Lenz Fiedler <l.fiedler_at_hzdr.de> wrote:

[...]

I have two representations in my file: One VDW for the ~130000 atoms and
> the second one, an isosurface, for their electronic density.
>

try reducing the number of triangles for your isosurface. you may have some
overflow there.

i.e. instead of:

mol modstyle 1 0 Isosurface 0.038714 0 0 0 1 1
>

try:

mol modstyle 1 0 Isosurface 0.038714 0 0 0 2 1
>

or:

mol modstyle 1 0 Isosurface 0.038714 0 0 0 4 1
> 

-- 
Dr. Axel Kohlmeyer  akohlmey_at_gmail.com  https://urldefense.com/v3/__http://goo.gl/1wk0__;!!DZ3fjg!ukbKW9jvlAmADSiZojrbdsGp4cEWYEQu5P_qsicvM224PdMPJA1LfvXqrXk6aq-Fhw$ 
College of Science & Technology, Temple University, Philadelphia PA, USA
International Centre for Theoretical Physics, Trieste. Italy.