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[lammps-users] question about TAD
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[lammps-users] question about TAD


From: Fernanda S Teixeira <nandast@...6816...>
Date: Thu, 28 Sep 2017 17:07:33 -0300

Dear user and developers,

  Does TAD command automatically raise the temperature of the system or it is necessary to langevin the atoms to the T_hi?
  Have I to unfix nve atoms before?

  Reading the documentation it seems it is automatic but the in lammps example (examples folder) it is used.

"  fix 1 all nvt temp ${thi} ${thi} 0.1"

Thanks,

Fernanda S Teixeira.