[QE-users] Quantum espresso installation problem in MAC

Kanka Ghosh kanka.ghosh at u-bordeaux.fr
Wed Nov 27 10:41:02 CET 2019


Hi Will, 

This is the MAC.inc file. 
PFA 

Regards, 
Kanka 

De: "Will DeBenedetti" <wjd74 at cornell.edu> 
À: "users" <users at lists.quantum-espresso.org> 
Envoyé: Mardi 26 Novembre 2019 17:31:31 
Objet: Re: [QE-users] Quantum espresso installation problem in MAC 

Hi Kanka, 
I have had the best luck compiling and linking libraries using the Intel Fortran compilers and MKL libraries on Macs. I never succeeded with GCC. Can you please send your MAKE.inc file? 

Thanks, 

Will DeBenedetti 
Cornell University 

On Tue, Nov 26, 2019 at 5:45 AM Kanka Ghosh < [ mailto:kanka.ghosh at u-bordeaux.fr | kanka.ghosh at u-bordeaux.fr ] > wrote: 



Hello, 

I am trying to install quantum espresso in iMac (macOS Mojave, version 10.14.6). While it configured properly, I am facing some issues while compiling with make all or make pw or any make command. It is showing the following error after executing make all command : 








make all 

test -d bin || mkdir bin 

( cd clib ; /Library/Developer/CommandLineTools/usr/bin/make TLDEPS= all || exit 1 ) 

gcc -O3 -D__FFTW3 -D__MPI -I/Users/kghosh/Downloads/qe-6.4.1//include -I/Users/kghosh/Downloads/qe-6.4.1//FoX/finclude -I/Users/kghosh/Downloads/qe-6.4.1//S3DE/iotk/include/ -c customize_signals.c 

gcc -O3 -D__FFTW3 -D__MPI -I/Users/kghosh/Downloads/qe-6.4.1//include -I/Users/kghosh/Downloads/qe-6.4.1//FoX/finclude -I/Users/kghosh/Downloads/qe-6.4.1//S3DE/iotk/include/ -c stack.c 

In file included from stack.c:9 : 

/usr/local/lib/gcc/x86_64-apple-darwin18.5.0/8.3.0/include-fixed/stdio.h:78:10: fatal error: _stdio.h: No such file or directory 

#include <_stdio.h> 

^~~~~~~~~~ 

compilation terminated. 

make[1]: *** [stack.o] Error 1 

make: *** [libs] Error 1 


Can anybody help to overcome this issue ? I have installed all gcc compilers as well as the libraries using brew in the machine. 

Thanks in advanced, 

Kanka 
Postdoc, I2M-bordeaux 
University of Bordeaux, CNRS UMR 5295 
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