[QE-users] qe 6.5 seemingly cannot use libxc 5.0.0

[Lorenzo Monacelli]

Hi,

This is actually an issue of libxc 5.0, they wrongly removed the fortran 
03 binding instead of the fortran 90. This issue will be solved likely 
in the next libxc version.

It has already been fixed in the gitlab repository

https://gitlab.com/libxc/libxc/-/merge_requests/305

On 27/05/20 23:38, José C. Conesa wrote:
>
> Hi,
>
> I tried using libxc v. 5.0.0 with qe-6.5 and was unable to do it. 
> Seemingly libxc 5.00 no longer contains the library libxcf03, while 
> funct.f90 requires the associated module xc_f03_lib_m.mod. This should 
> be solved in a new version of qe.
>
> Best regards,
>
> -- 
> José C. Conesa
> Instituto de Catálisis y Petroleoquímica, CSIC
> Marie Curie 2, Cantoblanco
> 28049 Madrid, Spain
> Tel. (+34)915854766
>
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