[QE-users] compiling QE with Ubuntu 22.04

Matteo Cococcioni matteo.cococcioni at unipv.it
Fri Oct 7 10:28:19 CEST 2022


Dear users,

apparently the intel oneapi c compiler icc does not like Ubuntu 22.04
and/or viceversa and there is some incompatibility between the two which
I was not able to solve.
Following Prof. Giannozzi's advice I manage to compile after switching icc
--> gcc. I haven't tested the code yet, but I hope it works normally.

Matteo


Il giorno ven 7 ott 2022 alle ore 10:02 Matteo Cococcioni <
matteo.cococcioni at unipv.it> ha scritto:

> Dera Chris,
>
> thanks for your advice. Unfortunately it does not work for me, not even
> upgradig git (which I didn't use anyway).
> My LD_LIBRARY_PATH seems to contain only oneapi locations.
> My problems seems related to /usr/include/stdio.h and
> /usr/include/stdlib.h:
>
> In file included from copy.c(3):
> /usr/include/stdio.h(830): error: attribute "__malloc__" does not take
> arguments
>     __attribute_malloc__ __attr_dealloc (pclose, 1) __wur;
>                          ^
>
> In file included from copy.c(4):
> /usr/include/stdlib.h(566): error: attribute "__malloc__" does not take
> arguments
>       __attr_dealloc_free;
>       ^
> Thanks,
>
> Matteo
>
>
>
> Il giorno ven 7 ott 2022 alle ore 07:26 Christoph Wolf
> <wolf.christoph at qns.science> ha scritto:
>
>> Dear Matteo,
>>
>> I just tested with 22.04 and intel one API and the gitlab version with a
>> simple  ./configure --prefix=... worked without issues. On an older machine
>> I had some obscure error related to git, which was simply solved by
>> updating git.
>>
>> check if your LD_LIBRARY_PATH is properly set; I had some issues with
>> oneAPI not overwriting an older library location (no clue why).
>>
>> HTH!
>> Chris
>>
>> --
>> Group Leader "Theory of Quantum Systems at Surfaces"
>> IBS Center for Quantum Nanoscience
>> Seoul, South Korea
>>
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>
>
>
> --
> Matteo Cococcioni
> Department of Physics
> University of Pavia
> Via Bassi 6, I-27100 Pavia, Italy
> tel +39-0382-987485
> e-mail matteo.cococcioni at unipv.it
>


-- 
Matteo Cococcioni
Department of Physics
University of Pavia
Via Bassi 6, I-27100 Pavia, Italy
tel +39-0382-987485
e-mail matteo.cococcioni at unipv.it
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