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Lori A. Burns edited this page Apr 28, 2017 · 3 revisions

STOP! This page is out-of-date and is superseded by the docs

HDF5 Library

In Psi4, HDF5 is a data and file management library for CheMPS2.

Examples

  • #####Rely on Auto-Detection

    setup
    
  • #####Link Against Specific Location

    setup --hdf5-dir /path/to/hdf5/rootdir
    
  • #####Link Against Pre-Built Conda Psi4dependencies Package

    setup --conda-dependdir $CONDA/envs/p4dep
    

Imposing your will upon CMake

  • #####Relevant setup Options:

    --hdf5-dir PATH       The root directory for hdf5. 'include/hdf5.h' and
                          'lib/libhdf5.so' (or similar) should be in this
                          directory. If this is left blank cmake will attempt to
                          find one on your system. (default: None)
    
  • #####Relevant cmake Options:

    -DHDF5_ROOT=PATH      - preferred hdf5 directory
    

Notes

  • Dependency Status: Optional