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Bug in Cylindrical observables
From: |
Jean-Noël Grad |
Subject: |
Bug in Cylindrical observables |
Date: |
Fri, 15 Jan 2021 20:39:16 +0100 |
User-agent: |
Mozilla/5.0 (X11; Linux i686; rv:68.0) Gecko/20100101 Thunderbird/68.12.0 |
Dear ESPResSo users,
It has come to our attention that the Cartesian to Cylindrical
coordinate conversion code was calculating an incorrect angle phi. The
bug is present since ESPResSo 4.0.0 and affects the phi component of the
following observables:
* CylindricalVelocityProfile
* CylindricalFluxDensityProfile
* CylindricalLBVelocityProfile
* CylindricalLBVelocityProfileAtParticlePositions
* CylindricalLBFluxDensityProfileAtParticlePositions
This will be fixed in the upcoming release 4.2.0 (PR #4094).
If you rely on the value of the angle phi from these observables in your
simulations, you can update ESPResSo 4.1.4 locally with the following
git commands:
git remote add upstream https://github.com/espressomd/espresso.git
git fetch upstream pull/4096/head:pr-4096
git merge --ff-only pr-4096
Best regards,
Jean-Noël Grad
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