Thank you for quick reply So I downloaded QE-GPU version 5.4 and updated my CUDA version to 8.0.
After change the compilation command: *./configure --enable-parallel --enable-openmp --with-scalapack --enable-cuda --with-gpu-arch=sm_35 --with-cuda-dir=/usr/local/cuda-8.0/bin --without-magma --with-phigemm* (now I changed with scalapack) but it is showing *new error *that is: checking build system type... x86_64-unknown-linux-gnu checking Quantum ESPRESSO version... grep: /root/Quantum-Espresso/QE-GPU-5.4/..//Modules/version.f90: No such file or directory configure: error: Cannot compile against this version of Quantum ESPRESSO. Use v5.4 Is there any other prerequisites I missed? Regards Phanikumar On Mon, Dec 5, 2016 at 2:25 PM, Filippo SPIGA < [email protected]> wrote: > Dear Phanikumar, > > upgrade to QE v5.4 and upgrade to the latest QE-GPU from GIT ( > https://github.com/fspiga/QE-GPU/archive/5.4.tar.gz). I've just create a > tag to simplify checkout operations). > > Moreover you want to use MAGMA if you do not use ScaLAPACK. if you disable > both, most likely you will run single core LAPACK and there will be no gain > there in having GPU. > > On Dec 5, 2016, at 5:57 AM, Phanikumar Pentyala <[email protected]> > wrote: > > I am trying to install QE-GPU-14.10.0 in my server (details below). > while configuration it's not generating files and showing some error > (config.status: error: cannot find input file: ../include/fft_defs.h.in). > I am new to linux OS, please help me for successful installation of GPU > version. > > > > Command I used for configuration: ./configure --enable-parallel > --enable-openmp --enable-cuda --without-scalapack --with-gpu-arch=sm_35 > --with-cuda-dir=/usr/local/cuda-7.5/bin --without-magma --with-phigemm > > -- > Filippo SPIGA ~ Quantum ESPRESSO Foundation ~ http://www.quantum-espresso. > org > > > _______________________________________________ > Pw_forum mailing list > [email protected] > http://pwscf.org/mailman/listinfo/pw_forum >
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