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Re: [ESPResSo-users] Few quick questions. Electrostatics, LB.
From: |
Axel Arnold |
Subject: |
Re: [ESPResSo-users] Few quick questions. Electrostatics, LB. |
Date: |
Wed, 4 Feb 2015 18:09:41 +0100 |
Hi!
> On 04.02.2015, at 13:52, Harmanjit Singh <address@hidden> wrote:
>
> And I think I will have to have a non periodic_BC if I want the particles to
> move in all three directions (by electrostatic forces). The maximum
> periodicity that can be allowed for my problem is only in Z direction.
Yes, that is what you need, but electrostatics for this periodicity is only
provided by MMM1D, which is pretty slow. You can use Debye-Hückel with zero
inverse screening length to get plain Coulomb interactions, which are cheaper.
You don’t get any periodicity, but probably also don’t really need that, since
periodic effects along a 1d cylinder are pretty weak.
Best,
Axel
------------------------------------------------
JP Dr. Axel Arnold
ICP, Universität Stuttgart
Allmandring 3
70569 Stuttgart, Germany
Email: address@hidden
Phone: +49 711 685 67609