Skip to content
  • Alberto Garcia's avatar
    Merged PEXSI-solver interface code · fd38db27
    Alberto Garcia authored
    Please see the manual for the new options related to the PEXSI
    solver. Keep in mind that this solver is competitive only for very
    large calculations.
    
    Alberto Garcia thanks Lin Lin, Chao Yang, Georg Huhs, and Nick Papior
    for their help with the design and coding of the interface.
    
    Developer note: Please see the "Notes for PEXSI operation" in
    Src/siesta.F for a brief overview of the basic coding changes
    that need to be kept into account for further development work.
    
    
    fd38db27