[QE-users] Failed install of executables on Mac

Paolo Giannozzi p.giannozzi at gmail.com
Thu Apr 1 11:46:47 CEST 2021


On Thu, Apr 1, 2021 at 11:24 AM Dario Massa <dario.massa at studenti.unipd.it>
wrote:

Fatal Error: fftw3.f: No such file or directory
>

That file is part of the fftw v.3 software. If you have fftw v.3 libraries
on your computer, check whether IFLAGS in make.inc contains a pointer to
the directory where that file is. If that file is not present on your
computer (sometimes libraries are split into 'binaries' and 'development'
and header files are in the latter) you need to install it, or to get a
copy and put it into include/

Paolo


compilation terminated.
> make[1]: *** [fft_scalar.FFTW3.o] Error 1
> make: *** [libfft] Error 1
>
> Il giorno gio 1 apr 2021 alle ore 10:42 Arka Prava Sarkar <
> sarkar.arkaprava200 at gmail.com> ha scritto:
>
>> Hi Dario,
>> In the make.inc file, please write the following
>> CPP = gcc -E
>> Hope this will fix the problem
>>
>> On Thu, 1 Apr 2021 at 14:08, Dario Massa <dario.massa at studenti.unipd.it>
>> wrote:
>>
>>> Goodmorning,
>>>
>>> I report here an issue arising when trying to install QE v.6.7 on MacOs
>>> Big Sur 11.1.
>>> Configuration via ./configure is successful, but executables are not
>>> installed.
>>>
>>> May I ask what am I supposed to do or what am I possibly doing wrong?
>>>
>>> I report here below the error
>>>
>>> I thank you in advance for your time and support
>>> Kind regards,
>>> Dario
>>>
>>> dariomassa at MacBook-Air-di-Dario qe-6.7 % make pw
>>> test -d bin || mkdir bin
>>> ( cd clib ; /Applications/Xcode.app/Contents/Developer/usr/bin/make
>>> TLDEPS= all || exit 1 )
>>> make[1]: Nothing to be done for `all'.
>>> cd install ; /Applications/Xcode.app/Contents/Developer/usr/bin/make -f
>>> extlibs_makefile libfox
>>> if test ! -d ../FoX; then \
>>>         mkdir ../FoX; \
>>> (gzip -dc ../archive/fox.tgz | (cd ../FoX; tar -xvf -)); \
>>> cd ../FoX/fox/; export FC=gfortran; export FCFLAGS=""; \
>>> ./configure --prefix=/Users/dariomassa/Documents/qe-6.7//FoX ;\
>>>     touch cp_test; \
>>>     if cp -p cp_test cp_test_1; then \
>>>         echo "cp -p works"; \
>>>     else \
>>>         find -type f | xargs sed -i 's/cp -p/cp/g'; \
>>>     fi; \
>>> /Applications/Xcode.app/Contents/Developer/usr/bin/make install; cd ../;
>>> rm -fr fox;fi
>>> ( cd UtilXlib ; /Applications/Xcode.app/Contents/Developer/usr/bin/make
>>> TLDEPS= all || exit 1 )
>>> make[1]: Nothing to be done for `all'.
>>> cd install ; /Applications/Xcode.app/Contents/Developer/usr/bin/make -f
>>> extlibs_makefile liblapack
>>> make[1]: Nothing to be done for `liblapack'.
>>> cd install ; /Applications/Xcode.app/Contents/Developer/usr/bin/make -f
>>> extlibs_makefile libcuda
>>> make[1]: Nothing to be done for `libcuda'.
>>> ( cd LAXlib ; /Applications/Xcode.app/Contents/Developer/usr/bin/make
>>> TLDEPS= all || exit 1 )
>>> cpp -P -traditional -Uvector -D__FFTW3 -D__MPI
>>> -I/Users/dariomassa/Documents/qe-6.7//include
>>> -I/Users/dariomassa/Documents/qe-6.7//FoX/finclude  laxlib.h -o laxlib.fh
>>> !
>>> ! Copyright (C) 2003-2013 Quantum ESPRESSO group
>>> ! This file is distributed under the terms of the
>>> ! GNU General Public License. See the file `Licenselaxlib.h:4:52:
>>> warning: missing terminating ' character [-Winvalid-pp-token]
>>> ! GNU General Public License. See the file `License'
>>>                                                    ^
>>> '
>>> ! in the root directory of the present distribution,
>>> ! or http://www.gnu.org/copyleft/gpl.txt .
>>> !
>>>    include 'laxlib_low.fh'
>>>    include 'laxlib_mid.fh'
>>>    include 'laxlib_hi.fh'
>>>    include 'laxlib_param.fh'
>>>
>>>    INTEGER, EXTERNAL ::  ldim_block, ldim_cyclic, ldim_block_sca
>>>
>>> 1 warning generated.
>>> clang: error: no input files
>>> make[1]: *** [laxlib.fh] Error 1
>>> make: *** [libla] Error 1
>>>
>>>
>>>
>>> _______________________________________________
>>> Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
>>> users mailing list users at lists.quantum-espresso.org
>>> https://lists.quantum-espresso.org/mailman/listinfo/users
>>
>>
>>
>> --
>>
>> *Thanks and Regards,*
>>
>> *অর্ক প্রভ সরকার*
>>  *Arka Prava Sarkar*
>> *Junior Research Fellow, *
>> *Centre for Computational and Data Sciences (CCDS)*
>> *Indian Institute of Technology, Kharagpur*
>> *West Bengal-721302*
>> *email1 : sarkar.arkaprava200 at gmail.com <sarkar.arkaprava200 at gmail.com>*
>> *email2 : arkaps.ccds at iitkgp.ac.in <arkaps.ccds at iitkgp.ac.in>*
>> <http://www.linkedin.com/in/quantum-arka-phys-497052>
>> _______________________________________________
>> Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
>> users mailing list users at lists.quantum-espresso.org
>> https://lists.quantum-espresso.org/mailman/listinfo/users
>
> _______________________________________________
> Quantum ESPRESSO is supported by MaX (www.max-centre.eu)
> 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 206, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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