slackbuilds/academic/metalwalls/README

10 lines
401 B
Plaintext

MetalWalls (MW) is a molecular dynamics code dedicated to the
modelling of electrochemical systems. Its main originality is the
inclusion of a series of methods allowing to apply a constant
potential within the electrode materials.
For building the MPI version set the environment variable MPI=yes
this requires a MPI implementation either openmpi or mpich.
The final executable is metalwalls