Basis Set Schema¶
A full description of the basis set.
The following properties are required for a basis set.
Key Name Description Field Type center_data Shared basis data for all atoms/centers in the molecule object atom_map Mapping of all atoms/centers in the molecule to data in center_data array[string] name Name of the basis set string
The following keys are optional for the basis set specification.
Key Name Description Field Type schema_version No description provided. integer schema_name No description provided. string description Brief description of the basis set string