Re: [QE-users] build QE-GPU fails with PGI 18/Cuda9.2 (unrecognized command line option)

2019-03-13 Thread Christoph Wolf
runs fairly fast in about 3 min General routines calbec : 14.21s CPU 14.28s WALL ( 144 calls) fft : 23.74s CPU 23.91s WALL ( 206 calls) ffts : 1.04s CPU 1.04s WALL ( 36 calls) fftw : 0.88s CPU

Re: [QE-users] build QE-GPU fails with PGI 18/Cuda9.2 (unrecognized command line option)

2019-03-13 Thread Christoph Wolf
Dear all, I apologize for the previous email; apparently I loaded, then unloaded and forgot, the parallel environment; the build went smoothly after loading it and the performance is quite good (ausurf benchmark (I removed 28 atoms because of memory limitations) -- Postdoctoral Researcher

[QE-users] build QE-GPU fails with PGI 18/Cuda9.2 (unrecognized command line option)

2019-03-12 Thread Christoph Wolf
Dear all, I am trying to build the most recent stable version of QE-GPU with CUDA/PGI community edition. My environment is set up as follows echo $LD_LIBRARY_PATH /usr/local/cuda-9.2/lib64:/usr/local/pgi/18.10/linux86-64/2018/cuda/9.2/lib64:/usr/local/pgi/18.10/linux86-64/18.10/lib echo $CUDA