You run > ./install/configure CC=pgcc F77=pgf90 FC=pgf90 F90=pgf90 MPIF90=mpif90 --with-cuda=/usr/local/cuda --with-cuda-runtime=9.2 --with-cuda-cc=70 --enable-openmp LIBS=/usr/local/cuda/lib64/stubs/
but LIBS should point to a library, not to a directory On Thu, Oct 29, 2020 at 6:44 AM Sitangshu Bhattacharya < [email protected]> wrote: > Dear Louis, > > Thanks for your suggestion. I made the changes as you suggested, but some > other compiling error in line 92 is constantly appearing. > I am attaching the config.log file for you to check please... > > Regards, > Sitangshu > > On Tue, Oct 20, 2020 at 9:06 PM Sitangshu Bhattacharya < > [email protected]> wrote: > >> Dear Louis, many thanks for your help, I am attaching the log file... >> >> Regards >> Sitangshu >> >> On Tue, Oct 20, 2020 at 8:33 PM Sitangshu Bhattacharya < >> [email protected]> wrote: >> >>> Hi Peirto, I tried to run the QE config file after installing the pgi >>> compiler (20.9). It seems that pgifortran issue is now solved, but stuck >>> with libcuda: >>> Please let me know... >>> Thanks, >>> Sitangshu >>> >>> [root@agni q-e-gpu-qe-gpu-6.6a2]# ./configure CC=pgcc F77=pgf90 FC=pgf90 >>> F90=pgf90 MPIF90=mpif90 --with-cuda=/usr/local/cuda/bin >>> --with-cuda-runtime=9.2 --with-cuda-cc=70 --enable-openmp >>> checking build system type... x86_64-pc-linux-gnu >>> checking ARCH... x86_64 >>> checking setting AR... ... ar >>> checking setting ARFLAGS... ... ruv >>> checking whether the Fortran compiler works... yes >>> checking for Fortran compiler default output file name... a.out >>> checking for suffix of executables... >>> checking whether we are cross compiling... no >>> checking for suffix of object files... o >>> checking whether we are using the GNU Fortran compiler... no >>> checking whether pgf90 accepts -g... yes >>> configure: WARNING: F90 value is set to be consistent with value of MPIF90 >>> checking for mpif90... mpif90 >>> checking whether we are using the GNU Fortran compiler... no >>> checking whether mpif90 accepts -g... yes >>> checking version of mpif90... nvfortran 20.9-0 >>> checking for Fortran flag to compile .f90 files... none >>> setting F90... nvfortran >>> setting MPIF90... mpif90 >>> checking whether we are using the GNU C compiler... yes >>> checking whether pgcc accepts -g... yes >>> checking for pgcc option to accept ISO C89... none needed >>> setting CC... pgcc >>> setting CFLAGS... -fast -Mpreprocess >>> checking whether we are using the GNU Fortran 77 compiler... no >>> checking whether pgf90 accepts -g... yes >>> setting F77... pgf90 >>> using F90... nvfortran >>> setting FFLAGS... -O1 >>> setting F90FLAGS... $(FFLAGS) >>> setting FFLAGS_NOOPT... -O0 >>> setting CPP... cpp >>> setting CPPFLAGS... -P -traditional -Uvector >>> setting LD... mpif90 >>> setting LDFLAGS... >>> checking for Fortran flag to compile .f90 files... (cached) none >>> checking whether Fortran compiler accepts -Mcuda... yes >>> checking for nvcc... >>> /apps/compilers/pgi/2020/Linux_x86_64/20.9/compilers/bin/nvcc >>> checking whether nvcc works... no >>> configure: WARNING: CUDA compiler has problems. >>> checking for cuInit in -lcuda... no >>> configure: error: in >>> `/data_hpc/home/sitanshu/softwares/q-e-gpu-qe-gpu-6.6a2': >>> configure: error: Couldn't find libcuda >>> >>> >>> On Sun, Oct 18, 2020 at 12:50 PM Sitangshu Bhattacharya < >>> [email protected]> wrote: >>> >>>> Thank you Peitro, but the link only tells about nvhpc. I couldn't get >>>> the pgi compilers there... >>>> >>>> Regards, >>>> Sitangshu >>>> >>>> On Sun, Oct 18, 2020 at 12:14 PM Sitangshu Bhattacharya < >>>> [email protected]> wrote: >>>> >>>>> Dear all, >>>>> >>>>> I am in search of a pgi compiler V20+ to run QE on a V100 GPU. I >>>>> looked in the nvidia and pgi websites, but it seems some sort of tie up is >>>>> needed between the guest and pgi organizations. As this may take some >>>>> time, >>>>> may I know if there are any quick download links...? >>>>> >>>>> >>>>> Regards, >>>>> ********************************************** >>>>> Sitangshu Bhattacharya (সিতাংশু ভট্টাচার্য), Ph.D >>>>> Assistant Professor, >>>>> Room No. 2221, CC-1, >>>>> Electronic Structure Theory Group, >>>>> Department of Electronics and Communication Engineering, >>>>> Indian Institute of Information Technology-Allahabad >>>>> Uttar Pradesh 211 012 >>>>> India >>>>> Telephone: 91-532-2922000 Extn.: 2131 >>>>> Web-page: http://profile.iiita.ac.in/sitangshu/ >>>>> Institute: http://www.iiita.ac.in/ >>>>> >>>>> >>>> >>>> -- >>>> ********************************************** >>>> Sitangshu Bhattacharya (সিতাংশু ভট্টাচার্য), Ph.D >>>> Assistant Professor, >>>> Room No. 2221, CC-1, >>>> Electronic Structure Theory Group, >>>> Department of Electronics and Communication Engineering, >>>> Indian Institute of Information Technology-Allahabad >>>> Uttar Pradesh 211 012 >>>> India >>>> Telephone: 91-532-2922000 Extn.: 2131 >>>> Web-page: http://profile.iiita.ac.in/sitangshu/ >>>> Institute: http://www.iiita.ac.in/ >>>> >>>> >>> >>> -- >>> ********************************************** >>> Sitangshu Bhattacharya (সিতাংশু ভট্টাচার্য), Ph.D >>> Assistant Professor, >>> Room No. 2221, CC-1, >>> Electronic Structure Theory Group, >>> Department of Electronics and Communication Engineering, >>> Indian Institute of Information Technology-Allahabad >>> Uttar Pradesh 211 012 >>> India >>> Telephone: 91-532-2922000 Extn.: 2131 >>> Web-page: http://profile.iiita.ac.in/sitangshu/ >>> Institute: http://www.iiita.ac.in/ >>> >>> >> >> -- >> ********************************************** >> Sitangshu Bhattacharya (সিতাংশু ভট্টাচার্য), Ph.D >> Assistant Professor, >> Room No. 2221, CC-1, >> Electronic Structure Theory Group, >> Department of Electronics and Communication Engineering, >> Indian Institute of Information Technology-Allahabad >> Uttar Pradesh 211 012 >> India >> Telephone: 91-532-2922000 Extn.: 2131 >> Web-page: http://profile.iiita.ac.in/sitangshu/ >> Institute: http://www.iiita.ac.in/ >> >> > > -- > ********************************************** > Sitangshu Bhattacharya (সিতাংশু ভট্টাচার্য), Ph.D > Assistant Professor, > Room No. 2221, CC-1, > Electronic Structure Theory Group, > Department of Electronics and Communication Engineering, > Indian Institute of Information Technology-Allahabad > Uttar Pradesh 211 012 > India > Telephone: 91-532-2922000 Extn.: 2131 > Web-page: http://profile.iiita.ac.in/sitangshu/ > Institute: http://www.iiita.ac.in/ > > _______________________________________________ > Quantum ESPRESSO is supported by MaX (www.max-centre.eu) > users mailing list [email protected] > https://lists.quantum-espresso.org/mailman/listinfo/users -- 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
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