Hi, I am interested in testing thermal conductivity at the nano-scale. LAMMPS has a command to control thermal flux:
https://lammps.sandia.gov/doc/fix_heat.html But, I cannot find an equivalent command in GROMACS. I know that thermostats can be set in GROMACS, but they do not seem to have a notion of how much energy is added or removed. Is this possible to do in GROMACS? Sincerely, James Ryley -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.
