There are quite a few astrochemical simulation frameworks out there, specifically we could add dataset loader format for the following datasets: | Dataset name | Ready to go? | Format | Paper | Link | |--------|--------|--------|--------|--------| | UCLCHEM-NEATH | No | csv | Non-Equilibrium Abundances Treated Holistically (NEATH): the molecular composition of star-forming clouds Open Access | On Snellius | | 1D-CSE | No | csv | The UMIST Database for Astrochemistry 2022 | https://github.com/MarieVdS/rate22_cse_code | | osu2008 | Yes | HDF5 | CODES: Benchmarking Coupled ODE Surrogates (Janssen et al., 2024); adapted from Grassi et al. (2022) astrochemical network | https://doi.org/10.5281/zenodo.13749089 | | simple_reaction | Yes | HDF5 | CODES: Benchmarking Coupled ODE Surrogates (Janssen et al., 2024); synthetic baseline dataset | https://doi.org/10.5281/zenodo.14712934 | | branca24 | Yes | HDF5 | CODES: Benchmarking Coupled ODE Surrogates (Janssen et al., 2024); subset of Branca & Pallottini (2024) | https://doi.org/10.5281/zenodo.13624794 | | simple_primordial | Yes | HDF5 | CODES: Benchmarking Coupled ODE Surrogates (Janssen et al., 2024); primordial-chemistry baseline variant | https://doi.org/10.5281/zenodo.13754361 | | branca_norad | Yes | HDF5 | Derived from Branca & Pallottini astrochemical models; CODES-compatible dataset variant | https://doi.org/10.5281/zenodo.14041124 | | branca_large_kyr | Yes | HDF5 | Extended-timescale Branca astrochemical dataset; used in CODES-style surrogate evaluation | https://doi.org/10.5281/zenodo.14204650 | | branca_large_myr | Yes | HDF5 | Extended-timescale Branca astrochemical dataset; used in CODES-style surrogate evaluation | https://doi.org/10.5281/zenodo.14243267 | | cloud | Yes | HDF5 | CODES benchmark extension: cloud microphysics coupled ODE system | https://doi.org/10.5281/zenodo.18018572 | | cloud_parametric | Yes | HDF5 | CODES benchmark extension: parametric cloud microphysics dataset | https://doi.org/10.5281/zenodo.18018572 | | primordial | Yes | HDF5 | CODES benchmark extension: primordial chemistry coupled ODE dataset | https://doi.org/10.5281/zenodo.18018572 | | primordial_parametric | Yes | HDF5 | CODES benchmark extension: parametric primordial chemistry dataset | https://doi.org/10.5281/zenodo.18018572 |
There are quite a few astrochemical simulation frameworks out there, specifically we could add dataset loader format for the following datasets: