workflows broken

[briling]

the action after merging #78 failed. @YAY-C can you quickly see why? otherwise we can try to fix it in a fork so this repo is not flooded

[YAY-C]

so this is the problem:

Collecting pyscf==2.2.0 (from -r /home/runner/work/Q-stack/Q-stack/condaenv.8tcbhgwd.requirements.txt (line 6))
  Downloading pyscf-2.2.0.tar.gz (8.6 MB)
     ━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━━ 8.6/8.6 MB 92.3 MB/s eta 0:00:00
  Preparing metadata (setup.py): started
  Preparing metadata (setup.py): finished with status 'done'
        Update the VERSION argument <min> value.  Or, use the <min>...<max> syntax
        to tell CMake that the project requires at least <min> but has been updated
        to work with policies introduced by <max> or earlier.
  
      -- The C compiler identification is GNU 13.3.0
      -- The CXX compiler identification is GNU 13.3.0
      -- Detecting C compiler ABI info
      -- Detecting C compiler ABI info - done
      -- Check for working C compiler: /usr/bin/cc - skipped
      -- Detecting C compile features
      -- Detecting C compile features - done
      -- Detecting CXX compiler ABI info
      -- Detecting CXX compiler ABI info - done
      -- Check for working CXX compiler: /usr/bin/c++ - skipped
      -- Detecting CXX compile features
      -- Detecting CXX compile features - done
      -- Performing Test COMPILER_SUPPORTS_SSE3
      -- Performing Test COMPILER_SUPPORTS_SSE3 - Success
      -- Looking for sgemm_
      -- Looking for sgemm_ - not found
      -- Performing Test CMAKE_HAVE_LIBC_PTHREAD
      -- Performing Test CMAKE_HAVE_LIBC_PTHREAD - Success
      -- Found Threads: TRUE
      -- Could NOT find BLAS (missing: BLAS_LIBRARIES)
      -- Looking for ffsll
      -- Looking for ffsll - found
      CMake Error at CMakeLists.txt:76 (message):
        A required library with BLAS API not found.
      
      
      -- Configuring incomplete, errors occurred!
      error: command '/usr/local/bin/cmake' failed with exit code 1
      [end of output]
  
  note: This error originates from a subprocess, and is likely not a problem with pip.
  ERROR: Failed building wheel for pyscf
ERROR: ERROR: Failed to build installable wheels for some pyproject.toml based projects (pyscf)

[briling]

closed by #81 thank you @YAY-C