Adding experimental branch for calculation of the heatflux based on old version of OpenMD. This will need to be ported to the development branch later.
removing spurious cutoffGroup lines from default water.md sample files
Almost all of the changes necessary to create OpenMD out of our old project (OOPSE-4)
Added large quantities of code for convex hull and constant pressure langevin dynamics.
Changes....
Added surfaces for Ni and Pd.
Added more surfaces.
Added samples for metal slabs.