Dear Filippo and Developers, Further update to my problem on compiling the QE-GPU 14.10.0 on a standalone GPU server with 8x Tesla C2050s.
I used ./configure CC=icc F90=ifort F77=ifort MPIF90=mpiifort \ --enable-parallel --disable-openmp --without-scalapack \ --enable-cuda --with-gpu-arch=sm_20 --with-cuda-dir=/usr/local/cuda-6.5 \ --with-magma --with-phigemm \ LDFLAGS="-L/usr/lib64/ -lstdc++" \ DFLAGS="-DMPICH_SKIP_MPICXX" Then I modified the make.sys file as attached (renamed as make_GPU.sys) As I compile, it stops and the final error is ... ifort: command line remark #10010: option '-vec-report0' is deprecated and will be removed in a future release. See '-help deprecated' /usr/local/cuda-6.5/bin/nvcc -gencode arch=compute_20,code=sm_20 -I../../include -I../include -I/home/zgdeng/QE520-GPU/espresso-5.2.0/GPU/..//qe-magma/include -I/home/zgdeng/QE520-GPU/espresso-5.2.0/GPU/..//quark/include -I/home/zgdeng/QE520-GPU/espresso-5.2.0/GPU/..//phiGEMM/include -I/usr/local/cuda-6.5/include -DMPICH_SKIP_MPICXX -D__DISABLE_CUDA_ADDUSDENS -D__DISABLE_CUDA_VLOCPSI -D__DISABLE_CUDA_NEWD -c cuda_init.cu cuda_init.cu(383): error: identifier "ngpus_per_process" is undefined cuda_init.cu(385): error: identifier "qe_gpu_bonded" is undefined cuda_init.cu(398): error: identifier "qe_gpu_kernel_launch" is undefined cuda_init.cu(398): error: identifier "update_gpu_kernel_specs" is undefined cuda_init.cu(435): warning: variable "lRankThisNode" was declared but never referenced cuda_init.cu(435): warning: variable "lSizeThisNode" was declared but never referenced 4 errors detected in the compilation of "/tmp/tmpxft_0000411c_00000000-6_cuda_init.cpp1.ii". make[1]: *** [cuda_init.o] Error 2 make[1]: Leaving directory `/home/zgdeng/QE520-GPU/espresso-5.2.0/GPU/Modules' make: *** [gpu-mods] Error 2 Could you help? Thanks very much, Rolly PhD, Research Fellow, Department of Physics and Materials Science, City University of Hong Kong Tel: +852 3442 4000 Fax:+852 3442 0538 Disclaimer: This email (including any attachments) is for the use of the intended recipient only and may contain confidential information and/or copyright material. If you are not the intended recipient, please notify the sender immediately and delete this email and all copies from your system. Any unauthorized use, disclosure, reproduction, copying, distribution, or other form of unauthorized dissemination of the contents is expressly prohibited.
make_GPU.sys
Description: make_GPU.sys
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