[ase-users] New ase trajectory module doesn't attach vasp calculator to atoms

[Jens Jørgen Mortensen]

On 04/01/2015 12:15 AM, Prateek Mehta wrote:
> Hi,
>
> I came across this issue trying to use ase-gui to view graphs of the 
> energy for trajectories written by the xdat2traj function in the vasp 
> calculator.
>
> It does not look like the calculator gets attached to the atoms in the 
> trajectory. The calculator used to be attached till svn revision 4193.

Can you show us an example and gives us the input files you use?

Jens Jørgen

>
> Thanks,
>
> Prateek
>
>
>
>
>
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