Diffusion lammps (lammm-devel) History

lammps/examples/neb/in.neb.hop1freeend
lammm-devele03cc994673e6b43ef41368…

Jun 2 2017

made the command options more lammps standard style
e03cc994673e
·Emile Maras on Jun 2 2017, 23:42.

May 29 2017

removed a bug in fix_neb.cpp which prevented the freeend to work properly, plus…
32c87f313180
·Emile Maras on May 29 2017, 14:00.