FeOs v0.10.1

feos-org.github.io

Tin mới

Working with SI-units

On Dual Numbers in FeOs

Equations of state

Working with parameters

Pure substance phase diagrams

Entropy scaling of pure substances

Implementing an equation of state in python

Density functional theory

Surface tension using PC-SAFT Helmholtz energy functionals

Critical point of a pure substance

Vapor pressure and boiling temperature of a pure substance

Phase equilibrium of a pure substance

Phase diagram of a pure substance

Phase equilibria including derivatives

Surface tension of a pure substance

Surface tension diagram of a pure substance

Calculation of contact angles with cDFT

Parameter handling

feos.Parameters.__init__

feos.Parameters.from_database

feos.Parameters.from_json

feos.Parameters.from_multiple_json

feos.Parameters.from_records

feos.Parameters.new_binary

feos.Parameters.new_pure

feos.Parameters.to_json_str

feos.GcParameters.__init__

feos.GcParameters.from_json_segments

feos.GcParameters.from_json_smiles

feos.GcParameters.from_segments

feos.GcParameters.from_smiles

feos.Identifier.__init__

feos.IdentifierOption

feos.IdentifierOption.__init__

feos.PureRecord.__init__

feos.PureRecord.from_json

feos.PureRecord.from_json_str

feos.PureRecord.to_dict

feos.PureRecord.to_json_str

feos.SegmentRecord

feos.SegmentRecord.__init__

feos.SegmentRecord.from_json

feos.SegmentRecord.from_json_str

feos.SegmentRecord.to_dict

feos.SegmentRecord.to_json_str

feos.BinaryRecord.__init__

feos.BinaryRecord.from_json_str

feos.BinaryRecord.to_dict

feos.BinaryRecord.to_json_str

feos.BinarySegmentRecord