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Re: [ESPResSo-users] simple shear for polymer melts

From: Pierre de Buyl
Subject: Re: [ESPResSo-users] simple shear for polymer melts
Date: Thu, 16 May 2019 15:47:23 +0200
User-agent: Mutt/1.5.23 (2014-03-12)

Dear Ricky,

With S. Bindgen, we are currently working on the Lees-Edwards feature - with
support from the ESPResSo developers. We hope to complete the work soon. In the
meantime, our work is available here and there is a
sample "".

The feature does not work with virtual sites or electrostatics.



On Thu, May 16, 2019 at 09:27:05PM +0800, address@hidden wrote:
> Dear all,
> I'd like to simulate the simple shear for polymer melts with the current 
> version of espresso(4.0.2). However, the Lees-Edwards boundary conditions are 
> not available according to the document.
> Do you have some ideas to simulate the shear flow?
> Thanks for your attention to this matter!
> Regards!
> Ricky
> address@hidden

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