[QE-users] problem with neb.x

[Paolo Giannozzi]

It seems to me that "CI_scheme" is misspelled (with an "l" instead of a
capital "i") (or a lowercase "i": names of variables are case-insensitive)

Paolo


On Tue, Aug 4, 2020 at 5:43 PM Rutika Savaliya <
rutika.savaliya at mail.mcgill.ca> wrote:

> Dear colleagues,
>
> I have found a problem when running neb calculation for adsorption of CH4
> on MoN surface splitting to CH3 on Mo and H on N. I have attached the
> input file for the calculation. The error shown will running on Compute
> Canada Server, its crash down with an error of following:
>
>
>
> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>      task #        30
>      from  path_read_namelists  : error #        19
>       reading namelist path
>
>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>
> I have been using qe version 6.1 for the calculation on cloud server of
> CEDAR on COMPUTE CANADA.
>
> Please give me some advice to solve this error.
>
> Regards,
> Rutika Savaliya
> Department of Chemical Engineering
> McGill University
>
>
> _______________________________________________
> Quantum ESPRESSO is supported by MaX (www.max-centre.eu/quantum-espresso)
> users mailing list users at lists.quantum-espresso.org
> https://lists.quantum-espresso.org/mailman/listinfo/users



-- 
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20200804/50fbf7c8/attachment.html>