[Pw_forum] How to install QE on mac
Gunar UFPA
gunar at ufpa.br
Mon May 1 22:33:48 CEST 2017
Paolo,
I installed the QE in may Mac with lapack, blas, fttw, bla library and I
did not have problems, but I am using intel fortran.
Please, install fttw and post again .
See you
Em seg, 1 de mai de 2017 às 16:52, Paolo Giannozzi <p.giannozzi at gmail.com>
escreveu:
> It looks like a problem of your compiler/assembler/OS, not of QE
>
> Paolo
>
> On Sun, Apr 30, 2017 at 5:17 PM, PRATIK DAS <pratikdas63 at gmail.com> wrote:
> > Dear sir,
> > I am trying to install QE on my mac. But every time it failed with the
> > following libiotk error. I am attaching the error messages herewith.
> > Please let me know where I am doing wrong.
> >
> > ERROR MESSAGE:
> >
> > Last login: Sun Apr 30 18:55:11 on ttys000
> >
> > Pratiks-MacBook-Air:~ pratikkumardas$ cd Desktop/espresso-5.1.2/
> >
> > Pratiks-MacBook-Air:espresso-5.1.2 pratikkumardas$
> >
> > Pratiks-MacBook-Air:espresso-5.1.2 pratikkumardas$
> >
> > Pratiks-MacBook-Air:espresso-5.1.2 pratikkumardas$ ls
> >
> > COUPLE README espresso-5.1.2
> >
> > CPV S3DE espresso-5.1.2.tar.gz
> >
> > Doc archive flib
> >
> > License bin include
> >
> > Makefile clib install
> >
> > Modules configure make.sys
> >
> > PP dev-tools pseudo
> >
> > PW environment_variables upftools
> >
> > Pratiks-MacBook-Air:espresso-5.1.2 pratikkumardas$ ./configure
> >
> > checking build system type... i386-apple-darwin15.5.0
> >
> > detected architecture... mac686
> >
> > checking for ifort... no
> >
> > checking for gfortran... gfortran
> >
> > configure: WARNING: using cross tools not prefixed with host triplet
> >
> > checking for Fortran compiler default output file name... a.out
> >
> > checking whether the Fortran compiler works... yes
> >
> > checking whether we are cross compiling... yes
> >
> > checking for suffix of executables...
> >
> > checking for suffix of object files... o
> >
> > checking whether we are using the GNU Fortran compiler... yes
> >
> > checking whether gfortran accepts -g... no
> >
> > checking for Fortran flag to compile .f90 files... none
> >
> > checking for mpif90... no
> >
> > checking for gfortran... gfortran
> >
> > checking whether we are using the GNU Fortran compiler... yes
> >
> > checking whether gfortran accepts -g... no
> >
> > checking version of gfortran... gfortran 4.2.3
> >
> > setting F90... gfortran
> >
> > setting MPIF90... gfortran
> >
> > checking for cc... cc
> >
> > checking whether we are using the GNU C compiler... yes
> >
> > checking whether cc accepts -g... yes
> >
> > checking for cc option to accept ISO C89... none needed
> >
> > setting CC... cc
> >
> > checking how to run the C preprocessor... cc -E
> >
> > checking for grep that handles long lines and -e... /usr/bin/grep
> >
> > checking for egrep... /usr/bin/grep -E
> >
> > checking for ANSI C header files... yes
> >
> > checking for sys/types.h... yes
> >
> > checking for sys/stat.h... yes
> >
> > checking for stdlib.h... yes
> >
> > checking for string.h... yes
> >
> > checking for memory.h... yes
> >
> > checking for strings.h... yes
> >
> > checking for inttypes.h... yes
> >
> > checking for stdint.h... yes
> >
> > checking for unistd.h... yes
> >
> > checking size of int *... 8
> >
> > checking malloc.h usability... no
> >
> > checking malloc.h presence... no
> >
> > checking for malloc.h... no
> >
> > checking for gfortran... gfortran
> >
> > checking whether we are using the GNU Fortran 77 compiler... yes
> >
> > checking whether gfortran accepts -g... no
> >
> > setting F77... gfortran
> >
> > using F90... gfortran
> >
> > setting FFLAGS... -O3 -g
> >
> > setting F90FLAGS... $(FFLAGS) -x f95-cpp-input
> >
> > setting FFLAGS_NOOPT... -O0 -g
> >
> > setting CFLAGS... -O3
> >
> > setting CPP... cpp
> >
> > setting CPPFLAGS... -P -C -traditional
> >
> > setting LD... gfortran
> >
> > setting LDFLAGS... -g -pthread
> >
> > setting AR... ar
> >
> > setting ARFLAGS... ruv
> >
> > checking whether make sets $(MAKE)... yes
> >
> > checking whether Fortran files must be preprocessed... no
> >
> > checking how to get verbose linking output from gfortran... -v
> >
> > checking for Fortran 77 libraries of gfortran...
> > -L/usr/local/lib/gcc/i686-apple-darwin8/4.2.3
> > -L/usr/local/lib/gcc/i686-apple-darwin8/4.2.3/../../.. -lgfortranbegin
> > -lgfortran
> >
> > checking for dummy main to link with Fortran 77 libraries... none
> >
> > checking for Fortran 77 name-mangling scheme... unknown
> >
> > configure: WARNING: unknown Fortran name-mangling scheme
> >
> > checking for library containing dgemm... no
> >
> > in /usr/local/lib: checking for library containing dgemm... no
> >
> > checking for library containing dgemm... no
> >
> > in /usr/local/lib: checking for library containing dgemm... no
> >
> > checking for library containing dspev... no
> >
> > in /usr/local/lib: checking for library containing dspev... no
> >
> > setting BLAS_LIBS...
> > /Users/pratikkumardas/Desktop/espresso-5.1.2/BLAS/blas.a
> >
> > setting LAPACK_LIBS...
> > /Users/pratikkumardas/Desktop/espresso-5.1.2/lapack-3.2/lapack.a
> >
> > checking for library containing dfftw_execute_dft... no
> >
> > in /usr/local/lib: checking for library containing dfftw_execute_dft...
> no
> >
> > setting FFT_LIBS...
> >
> > setting MASS_LIBS...
> >
> > checking for library containing mpi_init... no
> >
> > setting MPI_LIBS...
> >
> > checking for library containing mpi_init... (cached) no
> >
> > setting SCALAPACK_LIBS...
> >
> > setting DFLAGS... -D__GFORTRAN -D__STD_F95 -D__FFTW
> >
> > setting IFLAGS... -I../include
> >
> > setting FDFLAGS... $(DFLAGS)
> >
> > checking for ranlib... ranlib
> >
> > setting RANLIB... ranlib -c
> >
> > checking for wget... no
> >
> > checking for curl... curl -o
> >
> > setting WGET... curl -o
> >
> > configure: creating ./config.status
> >
> > config.status: creating include/fft_defs.h
> >
> > config.status: creating make.sys
> >
> > config.status: creating configure.msg
> >
> > config.status: creating install/make_wannier90.sys
> >
> > config.status: creating install/make_blas.inc
> >
> > config.status: creating install/make_lapack.inc
> >
> > config.status: creating include/c_defs.h
> >
> > config.status: include/c_defs.h is unchanged
> >
> > --------------------------------------------------------------------
> >
> > ESPRESSO can take advantage of several optimized numerical libraries
> >
> > (essl, fftw, mkl...). This configure script attempts to find them,
> >
> > but may fail if they have been installed in non-standard locations.
> >
> > If a required library is not found, the local copy will be compiled.
> >
> >
> > The following libraries have been found:
> >
> > BLAS_LIBS=/Users/pratikkumardas/Desktop/espresso-5.1.2/BLAS/blas.a
> >
> >
> >
> LAPACK_LIBS=/Users/pratikkumardas/Desktop/espresso-5.1.2/lapack-3.2/lapack.a
> >
> > FFT_LIBS=
> >
> > Please check if this is what you expect.
> >
> >
> > If any libraries are missing, you may specify a list of directories
> >
> > to search and retry, as follows:
> >
> > ./configure LIBDIRS="list of directories, separated by spaces"
> >
> >
> > Parallel environment not detected \(is this a parallel machine?\).\
> >
> > Configured for compilation of serial executables.
> >
> >
> > For more info, read the ESPRESSO User's Guide (Doc/users-guide.tex).
> >
> > --------------------------------------------------------------------
> >
> > configure: success
> >
> > Pratiks-MacBook-Air:espresso-5.1.2 pratikkumardas$
> >
> > Pratiks-MacBook-Air:espresso-5.1.2 pratikkumardas$
> >
> > Pratiks-MacBook-Air:espresso-5.1.2 pratikkumardas$
> >
> > Pratiks-MacBook-Air:espresso-5.1.2 pratikkumardas$
> >
> > Pratiks-MacBook-Air:espresso-5.1.2 pratikkumardas$ make all
> >
> > test -d bin || mkdir bin
> >
> > cd install ; /Library/Developer/CommandLineTools/usr/bin/make -f
> > extlibs_makefile libiotk
> >
> > if test ! -d ../S3DE; then \
> >
> > (gzip -dc ../archive/iotk-1.2.beta.tar.gz | (cd ../; tar -xvf -)) ; \
> >
> > if test -e Makefile_iotk; then \
> >
> > (cp Makefile_iotk ../S3DE/iotk/src/Makefile); fi; \
> >
> > if test -e iotk_config.h; then \
> >
> > (cp iotk_config.h ../S3DE/iotk/include/iotk_config.h); fi; fi
> >
> > cd ../S3DE/iotk/src; /Library/Developer/CommandLineTools/usr/bin/make
> > lib+util;
> >
> > gfortran -O3 -g -x f95-cpp-input -D__GFORTRAN -D__STD_F95 -D__FFTW
> > -I../include -c iotk_base.f90
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:1:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs
> >
> "/Users/pratikkumardas/Desktop/espresso-5.1.2/S3DE/iotk/src/",100,0,7,Ltext0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:2:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs "iotk_base.f90",100,0,7,Ltext0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:5:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs "gcc2_compiled.",60,0,0,0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:55:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs
> >
> "iotk_error_pool:G(0,1)=ar(0,2)=r(0,2);-2147483648;2147483647;;0;99;(0,3)=xsiotk_error:",32,0,240,0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:56:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs "int4:t(0,2)",128,0,0,0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:57:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs
> > "iotk_error:T(0,3)=s24str:(0,4)=xsarray1_unknown:,0,192;;",128,0,0,0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:58:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs "iotk_indent:G(0,2)",32,0,284,0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:59:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs "iotk_error_warn_overflow:G(0,5)=@s32;-16;",32,0,293,0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:60:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs "logical4:t(0,5)",128,0,0,0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:61:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs
> "iotk_error_pool_used:G(0,6)=ar(0,2);0;99;(0,5)",32,0,246,0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:62:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs
> "iotk_error_pool_order:G(0,7)=ar(0,2);0;99;(0,2)",32,0,252,0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:63:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs "iotk_error_unit:G(0,2)",32,0,265,0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:64:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs "iotk_getline_buffer:G(0,2)",32,0,274,0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:65:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs "iotk_linlen:G(0,2)",32,0,281,0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:66:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs "iotk_maxindent:G(0,2)",32,0,287,0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:67:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs "iotk_output_unit:G(0,2)",32,0,267,0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:68:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs "iotk_unitmax:G(0,2)",32,0,263,0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:69:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs "iotk_unitmin:G(0,2)",32,0,261,0
> >
> > ^
> >
> > /var/folders/2g/571f7z014fz63skqj3gpqtcc0000gn/T//cc7XFxV2.s:71:9: error:
> > unsupported directive '.stabs'
> >
> > .stabs "",100,0,0,Letext0
> >
> > ^
> >
> > make[2]: *** [iotk_base.o] Error 1
> >
> > make[1]: *** [libiotk] Error 2
> >
> > make: *** [libiotk] Error 2
> >
> > Pratiks-MacBook-Air:espresso-5.1.2 pratikkumardas$
> >
> >
> >
> > Thank you in advance.
> >
> >
> > Best regards
> > Pratik
> >
> > ***********************
> > Pratik Kr. Das
> > Senior Research Fellow (DST-INSPIRE)
> > High Pressure and Temperature Lab
> > Faculty of Science
> > Jadavpur University
> > Kolkata 700032
> > Ph No. +91-9674162216
> >
> > _______________________________________________
> > Pw_forum mailing list
> > Pw_forum at pwscf.org
> > http://pwscf.org/mailman/listinfo/pw_forum
>
>
>
> --
> Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
> Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
> Phone +39-0432-558216, fax +39-0432-558222
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
>
--
Gmail for IPhone
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20170501/371e209b/attachment.html>
More information about the users
mailing list