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pyiron / pylammpsmpi

Parallel Lammps Python interface - control a mpi4py parallel LAMMPS instance from a serial python process or a Jupyter notebook
https://pylammpsmpi.readthedocs.io
BSD 3-Clause "New" or "Revised" License
30 stars 4 forks source link

New version 0.2.3 is not installed #142

Closed srmnitc closed 1 year ago

srmnitc commented 1 year ago

The import error with ´RaisingThread´ persists as the new version 0.2.3 is not installed by conda. When trying to install, it complains that a compatible LAMMPS version could not be found. On debugging a bi, lammps complained about libcurl version, libcurl about krb5, krb5 about pyqt where I stopped.

I am not sure what the solution is.

jan-janssen commented 1 year ago

Is this specific to cmti001 or a general issue? For me the installation worked fine and also the continuous integration works fine.

srmnitc commented 1 year ago

On a clean env on my workstation, it worked fine. So maybe one of the existing packages were causing the conflict. I will go ahead and close this issue.