Install QE 6.4.1 or QE 6.6 with Libxc.5.1.5 errors
Dear QE master:
The libxc.5.1.5 was installed correctly by our university HPC team. I just
want to install QE with this libxc.
1. I try to install QE 6.4.1 with libxc.5.1.5, I meet errors, when I
config QE by
./configure --enable-openmp -
Hello,
libxc-5.1.5 version is very recent, while QE 6.4.1 and 6.6 versions are
not. Backward compatibility of QE with libxc is ensured (at least since
v4.3.4), but the opposite obviously is not (but 6.6 should work, maybe with
some limitations).
In QE 6.6 and later you should use -lxcf03, not -lxcf
: Fabrizio FerrariSubject: RE: [QE-users] Install QE 6.4.1 or QE 6.6 with Libxc.5.1.5 errors I don know how libxc.5.1.5 was compiled. It was done by our Temple HPC team. But I saw is was libxc/5.1.5-intel. It should be compiled with intel compiler. Best,Hong Sent from Mail for Windows 10 From: Fabrizio
intel
> compiler.
>
>
>
> Best,
>
> Hong
>
>
>
>
>
> Sent from Mail <https://go.microsoft.com/fwlink/?LinkId=550986> for
> Windows 10
>
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> *From: *Fabrizio Ferrari
> *Sent: *Monday, July 19, 2021 2:01 PM
> *To: *tanghong...@gmail
.5.1.5? Best,Hong Sent from Mail for Windows 10 From: tanghong...@outlook.comSent: Monday, July 19, 2021 2:04 PMTo: Fabrizio FerrariSubject: RE: [QE-users] Install QE 6.4.1 or QE 6.6 with Libxc.5.1.5 errors I don know how libxc.5.1.5 was compiled. It was done by our Temple HPC team. But I saw
osoft.com/fwlink/?LinkId=550986> for
> Windows 10
>
>
>
> *From: *Fabrizio Ferrari
> *Sent: *Monday, July 19, 2021 2:18 PM
> *To: *tanghong...@outlook.com
> *Cc: *users@lists.quantum-espresso.org
> *Subject: *Re: [QE-users] Install QE 6.4.1 or QE 6.6 with Libxc.5.1.5
>
libxc.5.1.5 was not compiled with intel
>> compiler? I can check with our HPC team.
>>
>> Please give me the advice how I should compile libxc.5.1.5?
>>
>>
>>
>> Best,
>>
>> Hong
>>
>>
>>
>>
>>
>>
>>
&
