Hello everyone,
Sorry if my question does not fit here very well. I am trying to get access to the rNEMD-modified code for atom swaps of unequal masses developed by Craig Tenney. I have searched a lot in the Lammps mailing list to find this code/discussion; couldn’t find it. Can anybody please point me to the right directory/link where I can find this discussion?
Thank you very much
Who says that this would be discussed here? Have you contacted the author? That is usually the best chance to get information about a feature that was developed outside the LAMMPS distribution and not submitted for inclusion (or not successful in submitting).
Thank you @akohlmey for your response. I am asking this because, on several topics, I have seen that there is a discussion about mailing list of detailed discussion about this code. For example, here in this link [lammps-users] temperature rising. Also, the modification has been recorded on the Lammps website LAMMPS History, under the name of Craig Terrey. So, I was wondering where can I find this code. Also, I would appreciate it if someone could advise on how can I modify rNEMD command to do the swapping for atoms of different masses. I did not find any specific recommendation for this in the mailing list or in LAMMPS documentation.
Thank you,
Then it will be in the LAMMPS distribution and you have to study the LAMMPS documentation or the source code of the commands that are mentioned.