cattsunami.core.reaction#
Classes#
Initialize Reaction object |
Module Contents#
- class cattsunami.core.reaction.Reaction(reaction_db_path: str, adsorbate_db_path: str, reaction_id_from_db: int | None = None, reaction_str_from_db: str | None = None, reaction_type: str | None = None)#
Initialize Reaction object
- reaction_db_path#
- reaction_db#
- adsorbate_db#
- entry#
- get_desorption_mapping(reactant)#
Get mapping for desorption reaction