nixpkgs/pkgs/applications/science/chemistry
Markus Kowalewski 6dba41fbcb
mpi: use mpi attribute consistently as the default MPI implementations
Use the attribute mpi to provide a system wide default MPI
implementation. The default is openmpi (as before).
This now allows for overriding the MPI implentation by using
the overlay mechanism. Build all packages with mpich instead
of the default openmpi can now be achived like this:
self: super:
 {
   mpi = super.mpich;
 }

All derivations that have been using "mpi ? null" to provide optional
building with MPI have been change in the following way to allow for
optional builds with MPI:
{ ...
, mpi
, useMpi ? false
}
2021-01-23 12:15:13 +01:00
..
avogadro treewide: pkgs.pkgconfig -> pkgs.pkg-config, move pkgconfig to alias.nix 2021-01-19 01:16:25 -08:00
d-seams treewide: with stdenv.lib; in meta -> with lib; 2021-01-11 10:38:22 +01:00
gwyddion treewide: stdenv.lib -> lib 2021-01-16 17:58:11 +07:00
jmol treewide: with stdenv.lib; in meta -> with lib; 2021-01-11 10:38:22 +01:00
marvin marvin: 20.20.0 -> 20.21.0 2021-01-20 05:27:37 +00:00
molden treewide: editorconfig fixes 2021-01-21 13:29:54 +10:00
octopus treewide: with stdenv.lib; in meta -> with lib; 2021-01-11 10:38:22 +01:00
openmolcas mpi: use mpi attribute consistently as the default MPI implementations 2021-01-23 12:15:13 +01:00
pymol treewide: Per RFC45, remove all unquoted URLs 2020-04-10 17:54:53 +01:00
quantum-espresso mpi: use mpi attribute consistently as the default MPI implementations 2021-01-23 12:15:13 +01:00
siesta mpi: use mpi attribute consistently as the default MPI implementations 2021-01-23 12:15:13 +01:00