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

[Paolo Giannozzi]

V.6.5 is three years old. Nobody has the time to look into problems of 
old versions that may have been fixed meanwhile

Paolo

On 09/02/2023 05:57, Arini Kar wrote:
> 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

-- 
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 206, 33100 Udine Italy, +39-0432-558216