feos.joback
¶
Ideal gas model based on the Joback & Reid GC method.
Example: Combine the ideal gas model of Joback & Reid with PC-SAFT¶
from feos.eos import EquationOfState, State
from feos.pcsaft import PcSaftParameters
from feos.joback import Joback
pc_saft_parameters = PcSaftParameters.from_json_smiles(
['CCC', 'CCCC'],
'smarts.json',
'pcsaft_group_parameters.json'
)
joback = Joback.from_json_smiles(
['CCC', 'CCCC'],
'smarts.json',
'joback_parameters.json'
)
eos = EquationOfState.pcsaft(pc_saft_parameters).joback(joback)
Data types¶
Create an identifier for a pure substance. |
|
Possible variants to identify a substance. |
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Create a set of Joback ideal gas heat capacity parameters for a segment or a pure component. |
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All information required to characterize a pure component. |
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All information required to characterize a single segment. |
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Ideal gas model based on the Joback & Reid GC method. |