Reaktoro  v2.11.0
A unified framework for modeling chemically reactive systems
StandardThermoModelExtendedUNIQUAC.hpp
1 // Reaktoro is a unified framework for modeling chemically reactive systems.
2 //
3 // Copyright © 2014-2024 Allan Leal
4 //
5 // This library is free software; you can redistribute it and/or
6 // modify it under the terms of the GNU Lesser General Public
7 // License as published by the Free Software Foundation; either
8 // version 2.1 of the License, or (at your option) any later version.
9 //
10 // This library is distributed in the hope that it will be useful,
11 // but WITHOUT ANY WARRANTY; without even the implied warranty of
12 // MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU
13 // Lesser General Public License for more details.
14 //
15 // You should have received a copy of the GNU Lesser General Public License
16 // along with this library. If not, see <http://www.gnu.org/licenses/>.
17 
18 #pragma once
19 
20 // Reaktoro includes
21 #include <Reaktoro/Core/StandardThermoModel.hpp>
22 
23 namespace Reaktoro {
24 
27 {
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59  real Theta = 200.0;
60 };
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64 
65 } // namespace Reaktoro
The namespace containing all components of the Reaktoro library.
Definition: Algorithms.hpp:29
autodiff::real real
The number type used throughout the library.
Definition: Real.hpp:26
auto StandardThermoModelExtendedUNIQUAC(StandardThermoModelParamsExtendedUNIQUAC const &params) -> StandardThermoModel
Return a function that calculates the thermodynamic properties of a substance using the extended UNIQ...
Model< StandardThermoProps(real T, real P)> StandardThermoModel
The function type for calculation of standard thermodynamic properties of a species.
Definition: StandardThermoModel.hpp:30
The parameters in the extended UNIQUAC model for calculating standard thermodynamic properties of sub...
Definition: StandardThermoModelExtendedUNIQUAC.hpp:27
real Hr
The standard molar enthalpy of formation of the substance at reference temperature 298....
Definition: StandardThermoModelExtendedUNIQUAC.hpp:32
real alpha
The parameter α in the standard heat capacity model (in 1/bar).
Definition: StandardThermoModelExtendedUNIQUAC.hpp:53
real c
The parameter c in the standard heat capacity model (in J/mol).
Definition: StandardThermoModelExtendedUNIQUAC.hpp:50
real Sr
The standard molar entropy of the substance at reference temperature 298.15 K (in J/(mol·K)).
Definition: StandardThermoModelExtendedUNIQUAC.hpp:35
real Gr
The standard molar Gibbs energy of formation of the substance at reference temperature 298....
Definition: StandardThermoModelExtendedUNIQUAC.hpp:29
real beta
The parameter β in the standard heat capacity model (in 1/bar²).
Definition: StandardThermoModelExtendedUNIQUAC.hpp:56
real b
The parameter b in the standard heat capacity model (in J/(mol·K²)).
Definition: StandardThermoModelExtendedUNIQUAC.hpp:47
real Vr
The standard molar volume of the substance at reference temperature 298.15 K (in m³/mol).
Definition: StandardThermoModelExtendedUNIQUAC.hpp:38
real a
The parameter a in the standard heat capacity model (in J/(mol·K)).
Definition: StandardThermoModelExtendedUNIQUAC.hpp:44
real Theta
The parameter Θ in the standard heat capacity model (in K).
Definition: StandardThermoModelExtendedUNIQUAC.hpp:59
real Cp
The standard molar heat capacity (constant pressure) of the substance at reference temperature 298....
Definition: StandardThermoModelExtendedUNIQUAC.hpp:41