recordSubstanceData

Base substance data based on Shomate equations http://old.vscht.cz/fch/cz/pomucky/fchab/Shomate.html

Parameters

TypeNameDefaultDescription
Modelica.Units.SI.MolarMassMolarWeight0.01801528Molar weight of the substance
Modelica.Units.SI.ChargeNumberOfIonz0Charge number of the substance (e.g., 0..uncharged, -1..electron, +2..Ca^(2+))
Modelica.Units.SI.MolarEnergyDfGDfG_25degC_1barGibbs energy of formation of the substance at SATP conditions (25 degC, 1 bar)
Modelica.Units.SI.MolarEnergyDfHDfH_25degCEnthalpy of formation of the substance at SATP conditions (25 degC, 1 bar)
Modelica.Units.SI.ActivityCoefficientgamma1Activity coefficient of the substance
Modelica.Units.SI.MolarHeatCapacityCpcp_25degCMolar heat capacity of the substance at SATP conditions (25 degC, 1 bar)
String[1]References{""}References of these thermodynamical values
BooleanSelfClusteringfalsePure substance is making clusters (weak bonds between molecules)
Modelica.Units.SI.ChemicalPotentialSelfClustering_dH0Enthalpy of bond between two molecules of substance at 25degC, 1 bar
Modelica.Units.SI.MolarEntropySelfClustering_dS0Entropy of bond between twoo molecules of substance at 25degC, 1 bar
RealB0Shomate parameter B
RealC0Shomate parameter C
RealD0Shomate parameter D
RealE0Shomate parameter E
RealX0Shomate parameter X
RealA_0Shomate parameter A'
RealE_1e-8Shomate parameter E'
Obsolete
Modelica.Units.SI.MolarEnergyDfG_25degC_1bar0Obsolete parameter use DfH instead
Modelica.Units.SI.MolarEnergyDfH_25degC0Obsolete parameter use DfG instead
Realcp_25degC33.6Obsolete parameter use Cp instead

Revisions

2016-2018

Marek Matejak, Charles University, Prague, Czech Republic