Gijs Vermariën

Hi Joseph! Thank you for your message, I have encountered this issue too at some point but hadn't made an issue out of it yet. In the refactoring of UCLCHEM...

The problem seems to be that we never check for the scenario where `bulklist` is not defined in chemistry.f90 when recomputing the bulk and surface: https://github.com/uclchem/UCLCHEM/blob/9cae8549d9c412e7ab323534a7c58f8636c2383e/src/fortran_src/chemistry.f90#L176

Hi Joseph, I think you could still use UCLCHEM for this! If you were to remove all the grain reactions (see this file for the defaults: https://github.com/uclchem/UCLCHEM/blob/main/Makerates/inputFiles/default_grain_network.csv), you would just...

After some discussion we decided to move to supporting WSL on Windows instead of building binaries for Windows.

Yes! There might be more pandas deprecations lingering around, such as not being able to write array elements to one pandas column, see: https://github.com/uclchem/SpectralRadex/commit/0dff9b74ad9bf4d0d4d3bf20e949252ed90d9b04 So I will try to comb...

Hi Jaime, Unfortunately we do not support pandas > 2.0 for now. Please downgrade to the latest supported version: https://pandas.pydata.org/docs/whatsnew/v1.5.3.html Best, Gijs

I determined that the origin of these .mod files is an vscode extension that creates .mod files. Still, these files should not be included during the build process!

Discussion on why to use notebook

Relevant issues: - https://github.com/numpy/numpy/issues/7855 - https://github.com/numpy/numpy/issues/26681 - https://stackoverflow.com/questions/32873308/updating-long-running-fortran-subroutine-in-python-gui-using-f2py

The last working version of the Fortran CLI can be found in the tag: https://github.com/uclchem/UCLCHEM/releases/tag/working_fortran_cli