feos.gc_pcsaft.GcPcSaftFunctionalParameters¶
- class feos.gc_pcsaft.GcPcSaftFunctionalParameters¶
Methods
__init__
()Creates parameters using segments from json file.
from_json_smiles
(identifier, smarts_path, ...)Creates parameters from SMILES using segments from json file.
from_segments
(chemical_records, segment_records)Creates parameters from segment records.
from_smiles
(identifier, smarts_records, ...)Creates parameters from SMILES and segment records.
Attributes
graph
k_ij