[CP2K-user] Compiling error of SIRIUS-6.4.4

vitesse lin vites... at gmail.com
Wed Jan 22 06:38:51 UTC 2020


Hi CP2K users,

Environment: Centos7.7

Hi I am trying the latest codebase with commit 
"0c352fb614e2ad9bd9c77166093b1cf4df31fd19".
I will hit error when I execute the command. "./install_cp2k_toolchain.sh 
--math-mode=mkl --with-reflapack=no --with-scalapack=no --with-elpa=no 
--libint-lmax=5 --with-mkl=/opt/intel/mkl"

==================== Installing SIRIUS ====================
sirius_6.4.4.tar.gz is found
Installing from scratch into 
/home/master/Desktop/HPC/cp2k/cp2k/tools/toolchain/install/sirius-6.4.4
ERROR: (./scripts/install_sirius.sh, line 130) Non-zero exit code detected.


CMake Error at CMakeLists.txt:121 (find_package):
  Could not find a package configuration file provided by "SpFFT" (requested
  version 0.9.6) with any of the following names:

    SpFFTConfig.cmake
    spfft-config.cmake

  Add the installation prefix of "SpFFT" to CMAKE_PREFIX_PATH or set
  "SpFFT_DIR" to a directory containing one of the above files.  If "SpFFT"
  provides a separate development package or SDK, be sure it has been
  installed.


-- Configuring incomplete, errors occurred!


The issue occurs if I use new SIRIUS-6.4.4+SpFFT-0.9.10 version and it 
won't occurs if I use SIRIUS-6.4.4+SpFFT-0.9.8.


Does there anyone hit the same problem?


Thanks.
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