Hi all!
I am getting an error saying
"Switching rotation per particle (#define ROTATION_PER_PARTICLE) and pressure calculation are incompatible."
if I include gamma_rot in thermostat Langevin although the code is running. can anyone tell me what does it mean?
I also wanted to know if i want to set gamma and gamma_rot separately for invidual particle in a system, for the
following command
"
part 1 pos 1.0 1.0 1.0 type 3 temp 1.0 gamma <GAMMA> gamma_rot <GAMMA_R>"
Espresso is giving error saying "unknown particle parameter "gamma_rot"". Can anyone clarify this to me. And if I want to set gamma and gamma rot separately for individual particles, do i still need to give the command of "thermostat langevin <temp> <gamma> <gamma_rot> on on"? In that case can I also not integrate the rotation of few particles in the system?
Regards,
Nairhita Samanta