[Octopus-devel] cvs commit: marques/octopus/src Makefile.am mf_inc.F90

[cvsusers at tddft.org]

acastro     2006/03/04 17:09:20 WET

  Modified files:
    octopus/src          Makefile.am mf_inc.F90 
  Log:
  A new external contribution: the qshep library, by Robert Renka. It
  implements something called the "Quadratic Shepard method for
  trivariate interpolation of scattered data". Basically what it does
  is interpolation to any arbitrary 2D or 3D grid.
  
  I am not sure wether or not this is the best possible software out
  there to do this, but since I do not know of any other that is free
  software, for the moment it is what we have. At least it is worthed
  to give it a try.
  
  The purpose of this library is to enhance the restart -- which for the
  moment does not happen, I just commit the library --. If the grid is
  modified in some way for restart, the code should interpolate the
  previous result. This is crucial to do convergence studies (with the
  simulation box size, with the grid spacing, with the parameters
  that define the curvilinear coordinates...).
  
  Revision  Changes    Path
  1.204     +2 -2      marques/octopus/src/Makefile.am
  1.51      +76 -1     marques/octopus/src/mf_inc.F90