[Octopus-devel] cvs commit: marques/octopus/expokit Makefile.am expokit.f

[cvsusers at tddft.org]

acastro     2005/07/14 08:38:11 WEST

  Added files:
    octopus/expokit      Makefile.am expokit.f 
  Log:
  Added the directory expokit, where the expokit.f file is placed exactly
  as it is in the expokit distribution. A library libexpokit.a is built now
  and linked to the octopus executable. Before the routines were included
  in the math module. However, this involved changing the routines to adapt
  them to Fortran 90, which was not as obvious as it seemed.
  
  The expokit.f file is large -- maybe we could remove some unused routines.
  
  I am touching this since soon I am experiencing with a new method do
  get the eigenvectors of the Hamiltonian: propagation in imaginary time.