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Re: [lammps-users] Phonon transmission in a mass-spring system
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Re: [lammps-users] Phonon transmission in a mass-spring system

From: Axel Kohlmeyer <akohlmey@...24...>
Date: Tue, 4 Jul 2017 11:24:12 -0400

On Tue, Jul 4, 2017 at 7:20 AM, Sen Gupta, Ashim <ashim.sen-gupta14@...68...> wrote:

Dear LAMMPS users,

I am looking to investigate the transmission of phonons and was looking to do this using LAMMPS (which I have never used before). If it helps at all, right now I'm using Debian 8, and the version of LAMMPS I have is: 16 Feb 16.

I am studying the transmission of phonons from one solid to another while crossing a vacuum gap via Van der Waals forces - the way I am doing this in practice is by first considering each solid to be a ( initially, 1D) chain of springs with some atomic mass and spring constant. In between these solids is another spring, with a different spring constant. What I want to do is set off a wave (with unit amplitude, for instance) in one solid and have it propagate, go across the 'interface' spring, and then into the second solid and thus find what the amplitude is in the second solid, allowing me to recover a transmission coefficient. I have attached an image, included below, from the following paper (page 2) by Ezzahri and Joulain, which shows, schematically, what I mean to simulate:

Could anyone let me know if there is any reference material that would help me understand how to translate what I've said above into code/input script? The friendlier it is to beginners, the better!

​LAMMPS comes with a very thick manual, it doesn't come with personal consulting and advising. people here on this mailing list are happy to answer specific questions to specific details and commands of the LAMMPS software, but nobody here has the time to devise a complete simulation setup for you and give you a customized personal tutorial.​



Any help would be appreciated!

Many Thanks,

Ashim Sen Gupta

Imperial College London

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Dr. Axel Kohlmeyer  akohlmey@...12...24...
College of Science & Technology, Temple University, Philadelphia PA, USA
International Centre for Theoretical Physics, Trieste. Italy.