struct Substance::Impl

Declaration

struct Substance::Impl { /* full declaration omitted */ };

Declared at: ThermoFun/Substance.cpp:11

Member Variables

public std::string name

The name of the chemical Substance

public std::string symbol

The name of the chemical Substance

public std::string formula

The chemical formula of the chemical Substance

public std::string reactionSymbol

The symbol of the reaction that defines the properties of this substance

public double molar_mass

The molar mass of the chemical Substance (in units of g/mol)

public double reference_T = 298.14999999999998

Reference temperature (in K, 298.15 default)

public double reference_P = 1.0E+5

Reference pressure (in Pa, 1e5 Pa default)

public double lower_T

Lower temperature limit (in K)

public double lower_P

Lower pressure limit (in Pa)

public double upper_T

Upper temperature limit (in K)

public double upper_P

Upper pressure limit (in Pa)

public ThermoFun::listmethods TPMethods

list of Temperature and pressure correction methods in the order they will be executed

public MethodGenEoS_Thrift::type method_genEoS

General method (or equation of state for both T and P correction)

public MethodCorrT_Thrift::type method_T

Method of temperature correction of thermodynamic properties

public MethodCorrP_Thrift::type method_P

Method of pressure correction of thermodynamic properties

public SubstanceClass::type substance_class

Class of the substance COMPONENT, GASFLUID, AQSOLUTE, AQSOLVENT, SURFSPECIES, SITEMOIETY, OTHER_SC

public AggregateState::type aggregate_state

Agregate state of the substance

public SubstanceThermoCalculationType::type thermo_calculation_type

Type of calculation used for determining the substance properties using a defined PT correction model or from a reaction

public ThermoFun::ThermoPropertiesSubstance thermo_prop

Thermodynamic properties of the substance at temperature and pressure and at reference tempearature and reference presure (usually 298.15 K and 1e05 Pa)

public ThermoFun::ThermoPropertiesSubstance thermo_ref_prop

Thermodynamic properties of the substance at temperature and pressure and at reference tempearature and reference presure (usually 298.15 K and 1e05 Pa)

public ThermoFun::ThermoParametersSubstance thermo_param

Parameters used to calculate the thermodynamic properties of the substance at the desired temperature and pressure using a certain calculation model

public int charge

public std::string jString