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Re: [ESPResSo-devel] Local Bond order parameters

From: Axel Arnold
Subject: Re: [ESPResSo-devel] Local Bond order parameters
Date: Wed, 31 Aug 2016 22:03:14 +0200


Unfortunately, neither the parallel nor serial q6 codes that where developed at ICP by Dominic and Kai made it to the main repository, so, no, the order parameters are not included.

Both left some time ago, so the only chance is that someone at ICP cloned one of their branches, though the code still would need some cleanup and documentation.


Am 31.08.2016 um 19:28 schrieb Raffaela Cabriolu <address@hidden>:

Hello to everyone, 

I am a beginner of espressomd and I would like to know it the calculation of the Steinhardt local order parameters are included in espresso 3.3.1 .

I have found online the following presentation :

However, I could not find in the espresso' user guide any mention to it. I am using tcl to write my scripts. 

Thank you 

Raffaela Cabriolu, Post Doc scientist
Department of Chemistry
Norwegian University of Science and Technology (NTNU) Høgskoleringen 5,
Realfagbygget D3-126
7491 Trondheim, Norway

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