On Dec 6, 2016, at 4:50 AM, Phanikumar Pentyala <phani12.c...@gmail.com> wrote: > Initially I written my GPU was Tesla K40, but it is not. Actual series name > was NVIDIA Tesla K40m. Sorry for that, that was my mistake
Not a difference between the two apart the cooling. > If I try compilation with QE-5.3.0, It was different error (config.status: > error: cannot find input file: ../include/fft_defs.h.in) 5.4, not 5.3. Not worth looking at 5.3 with the latest version > IntelĀ® math kernel library (MKL) Yes, download them for free > IntelĀ® Message Passing Interface (MPI) library installation required or not? No, download Open MPi or install it via apt-get/yum/whatever on the system Moreover make sure you have any fort of FFTW installed in the system as well. -- Filippo SPIGA ~ Quantum ESPRESSO Foundation ~ http://www.quantum-espresso.org _______________________________________________ Pw_forum mailing list Pw_forum@pwscf.org http://pwscf.org/mailman/listinfo/pw_forum