[CP2K-user] installation of CP2K with support of CUDA

[Nikhil Maroli]

Dear all,

Im new here with CP2K.  My system has 3 GPU card (GTC 1070) and 2 x 12 core 
processor.
All the packages are installed and I have gone for   

./install_cp2k_toolchain.sh --install-all command and all the files are 
generated and kept in arch folder.


The end results are given below

Done!
Now copy:
  cp /home/user2/cp2k-6.1.0/tools/toolchain/install/arch/* to the 
cp2k/arch/ directory
To use the installed tools and libraries and cp2k version
compiled with it you will first need to execute at the prompt:
  source /home/user2/cp2k-6.1.0/tools/toolchain/install/setup
To build CP2K you should change directory:
  cd cp2k/makefiles/
  make -j 48 ARCH=local VERSION="sopt sdbg ssmp popt pdbg psmp"

arch files for GPU enabled CUDA versions are named "local_cuda.*"
arch files for valgrind versions are named "local_valgrind.*"
arch files for coverage versions are named "local_coverage.*"


I would like to run CP2K with my GPU+CPU, kindly instruct me what step i 
need to take further to install GPU version of the software.


I have tried
  make -j 48 ARCH=local_cuda VERSION="sopt sdbg ssmp popt pdbg psmp"

results are here

/home/user2/cp2k-6.1.0/makefiles/Makefile:129: recipe for target 'all' 
failed
make[2]: *** [all] Error 2
/home/user2/cp2k-6.1.0/makefiles/Makefile:118: recipe for target 'pdbg' 
failed
make[1]: *** [pdbg] Error 2
/home/user2/cp2k-6.1.0/makefiles/Makefile:129: recipe for target 'all' 
failed
make[2]: *** [all] Error 2
/home/user2/cp2k-6.1.0/makefiles/Makefile:118: recipe for target 'sdbg' 
failed
make[1]: *** [sdbg] Error 2
Makefile:113: recipe for target 'all' failed
make: *** [all] Error 2


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