Dear Developer,
I am trying to do parallal installation of yambo-4.5.3 . I followed the procedure.
i) Inside the archive folder, I put tar files such as fftw-3.3.6-pl1.tar.gz, iotk-y1.2.2.tar.gz, lapack-3.6.1.tar.gz, libxc-2.2.3.tar.gz, netcdf-c-4.7.4.tar.gz, netcdf-fortran-4.5.2.tar.gz.
ii) options for configure- ./configure --enable-dp CC=icc FC=ifort PFC=mpiifort F77=ifort F90=ifort --with-blas-libs=libmkl_blas95_lp64.a --with-lapack-libs=libmkl_lapack95_lp64.a --with-scalapack-libs=libmkl_scalapack_lp64.a
iii) make all
However, the compilation is unsuccessful with the error mentioned below
ifort error #10236: File not found 'yambo-4.5.3/lib/external/intel/mpiifort/lib/liblapack.a
ifort error #10236: File not found 'yambo-4.5.3/lib/external/intel/mpiifort/lib/libblas.a
ifort error #10236: File not found 'yambo-4.5.3/lib/external/intel/mpiifort/lib/libfftw3.a
Any help will be appreciated.
Regards,
Bramhachari Khamari
Error in compilation of yambo-4.5.3
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If you have trouble compiling Yambo, please make sure to list:
(1) the compiler (vendor and release: e.g. intel 10.1)
(2) the architecture (e.g. 64-bit IBM SP5)
(3) if the problems occur compiling in serial/in parallel
(4) the version of Yambo (revision number/major release version)
(5) the relevant compiler error message
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Error in compilation of yambo-4.5.3
Bramhachari Khamari
Post Doctoral Fellow
Department of Physics
IIT Kanpur, India.
Post Doctoral Fellow
Department of Physics
IIT Kanpur, India.
- Daniele Varsano
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- Joined: Tue Mar 17, 2009 2:23 pm
- Contact:
Re: Error in compilation of yambo-4.5.3
Dear Bramhachari Khamari,
step 1 it is not needed.
you can just configure without specifying the
-with-blas-libs=--with-lapack-libs= --with-scalapack-libs= options.
yambo will download and compile the needed libraries.
if you do not want to use internal libraries that are eventually detected by the configure, you can add the option
--enable-int-linalg
if you want parallel linear algebra support (scalapack) you can use:
--enable-par-linalg
you can have a full list of options by typing
./configure -h
Best,
Daniele
step 1 it is not needed.
you can just configure without specifying the
-with-blas-libs=--with-lapack-libs= --with-scalapack-libs= options.
yambo will download and compile the needed libraries.
if you do not want to use internal libraries that are eventually detected by the configure, you can add the option
--enable-int-linalg
if you want parallel linear algebra support (scalapack) you can use:
--enable-par-linalg
you can have a full list of options by typing
./configure -h
Best,
Daniele
Dr. Daniele Varsano
S3-CNR Institute of Nanoscience and MaX Center, Italy
MaX - Materials design at the Exascale
http://www.nano.cnr.it
http://www.max-centre.eu/
S3-CNR Institute of Nanoscience and MaX Center, Italy
MaX - Materials design at the Exascale
http://www.nano.cnr.it
http://www.max-centre.eu/
-
- Posts: 96
- Joined: Wed Oct 23, 2019 5:52 am
Re: Error in compilation of yambo-4.5.3
Dear Sir,
Thank you for the reply.
Regards,
Bramhachari Khamari
Thank you for the reply.
Regards,
Bramhachari Khamari
Bramhachari Khamari
Post Doctoral Fellow
Department of Physics
IIT Kanpur, India.
Post Doctoral Fellow
Department of Physics
IIT Kanpur, India.