Open padamson opened 3 years ago
Okay I found it! Do you have an approach that you are leaning toward doing?
I kind of like option 1 because it also gives us the ability to generate formatted files for future submission to LXCat, and I can also use it in the verify_csdata step of the CurateLXCat template.
bolos can be used to obtain reaction rates and transport parameters for a given set of cross sections at a specified reduced electric field and gas temperature.
The proposal is for a new feature that provides reaction rates and transport parameters for a nepc Model at a given reduced electric field and gas temperature:
I think there are two possible approaches:
parser
to write a Model as an LXCat formatted file.Model.rates
writes the LXCat formatted file using this parser, then uses the approach in bolos sample file single.py to compute the rates.