[QE-users] Error in computing density of states using TB09 meta-GGA

[Arini Kar]

Dear Sir,

I have tried to run dos.x on a single processor post scf calculation 
using TB09 in QE v6.5. However I continue to encounter the same error as 
before.

  
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
      task #         0
      from set_dft_from_name : error #         1
      XC-000-000-000-000: unrecognized dft
  
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%

Regards
Arini Kar
PhD student
IIT Bombay, India

On 2023-02-08 18:19, Paolo Giannozzi wrote:

> On 2/8/23 05:12, Arini Kar via users wrote:
> 
>> task #        15
> 
> you should first of all try to run dos.x on a single processor. It is 
> not parallel anyway
> 
> Paolo
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20230209/bd7e141e/attachment.html>