[Pw_forum] The errors from IOTK library

[Oanh Nguyen]

Dear Pietro!
Thank you because of your help. I already download again the
pseudopotentials with the form of them :
Ta.pbe-hgh.UPF
Se.blyp-hgh.UPF
Pd.blyp-sp-hgh.UPF
So, Are they the GGA functional?
There are many the form of psedopotentila. How the way to determine what
the form of them is?
Your sincerely!

2016-10-25 14:15 GMT+07:00 Pietro Delugas <pdelugas at sissa.it>:

> Dear Oanh
>
> Check that the pseudopotential files that you are using are complete.
> Download them again from the QE site.
>
> Anyway 31 atoms and 20 bands, the computation is going to stop soon
> pietro
>
>
> On 25/10/2016 07:15, Oanh Nguyen wrote
>
> Dear users!
> I callculated 'scf" for PdxTaSe2 with input file below.
> I don't understand where is the errors when I run it.
> The errors is that: FROM IOTK LIBRARY, VERSION 1.2.0
> # UNRECOVERABLE ERROR (ierr=2)
> # ERROR IN: iotk_getline (iotk_scan.f90:947)
> # CVS Revision: 1.23
> #
> iostat=5008
> # ERROR IN: iotk_scan_tag (iotk_scan.f90:593)
> # CVS Revision: 1.23
> # ERROR IN: iotk_scan (iotk_scan.f90:821)
> # CVS Revision: 1.23
> # ERROR IN: iotk_scan_end (iotk_scan.f90:241)
> # CVS Revision: 1.23
> # foundl
> .......
> can you help me to fix them?
> Thank you>
>
>
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