Reaktoro  v2.11.0
A unified framework for modeling chemically reactive systems
ReactionStandardThermoModelVantHoff.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/ReactionStandardThermoModel.hpp>
22 
23 namespace Reaktoro {
24 
27 {
30 
33 
35  real Tr = 298.15;
36 
38  real Pr = 100'000;
39 };
40 
71 
72 } // 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
Model< ReactionStandardThermoProps(ReactionStandardThermoModelArgs)> ReactionStandardThermoModel
The function type for calculation of standard thermodynamic properties of a reaction.
Definition: ReactionStandardThermoModel.hpp:40
auto ReactionStandardThermoModelVantHoff(const ReactionStandardThermoModelParamsVantHoff &params) -> ReactionStandardThermoModel
Return a function that calculates thermodynamic properties of a reaction using van't Hoff's model.
The parameters in a van't Hoff thermodynamic model for a formation reaction.
Definition: ReactionStandardThermoModelVantHoff.hpp:27
real lgKr
The equilibrium constant (log base 10) of the reaction at and .
Definition: ReactionStandardThermoModelVantHoff.hpp:29
real dHr
The change in standard molar enthalpy of the reaction (in J/mol) at and .
Definition: ReactionStandardThermoModelVantHoff.hpp:32
real Tr
The reference temperature (in K).
Definition: ReactionStandardThermoModelVantHoff.hpp:35
real Pr
The reference pressure (in Pa).
Definition: ReactionStandardThermoModelVantHoff.hpp:38