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Re: [ESPResSo-users] Fwd: Error regarding rotational diffusion
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From: |
Rudolf Weeber |
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Subject: |
Re: [ESPResSo-users] Fwd: Error regarding rotational diffusion |
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Date: |
Mon, 13 Nov 2017 22:14:18 +0100 |
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User-agent: |
Mutt/1.5.24 (2015-08-30) |
Hi,
On Mon, Nov 13, 2017 at 11:54:23PM +0530, Nairhita Samanta wrote:
> "*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?
To my understanding, this error message should be removed, since the ideal gas
pressure is not influenced by the particles' angular velocities.
Regards, Rudolf