Calculation of accommodation coefficient by LAMMPS

Hi All,
Has anyone ever calculate thermal accommodation coeeficient by using LAMMPS? I just would like to know about the approach used.
Thanks,
Rose

Hi All,
Has anyone ever calculate thermal accommodation coeeficient by using LAMMPS? I just would like to know about the approach used.

i am confident that there is no direct command to provide this
automatically. it rarely is. but LAMMPS offers access to a lot of
properties during the simulation and flexible ways to account for
them. thus please look up how this property is generally computed,
then look up whether LAMMPS provides the facilities required, make
some tests to determine whether it is easier to do this directly
during a simulation or in post-processing and then do the real run for
your real system.

axel.