https://mooseframework.inl.gov
EquilibriumConstantAux.h
Go to the documentation of this file.
1 //* This file is part of the MOOSE framework
2 //* https://mooseframework.inl.gov
3 //*
4 //* All rights reserved, see COPYRIGHT for full restrictions
5 //* https://github.com/idaholab/moose/blob/master/COPYRIGHT
6 //*
7 //* Licensed under LGPL 2.1, please see LICENSE for details
8 //* https://www.gnu.org/licenses/lgpl-2.1.html
9 
10 #pragma once
11 
12 #include "AuxKernel.h"
13 #include "EquilibriumConstantFit.h"
14 #include "PolynomialFit.h"
15 
37 {
38 public:
40 
42 
43 protected:
44  virtual Real computeValue() override;
45 
49  const std::vector<Real> & _temperature_points;
51  const std::vector<Real> & _logk_points;
53  std::unique_ptr<EquilibriumConstantFit> _logk;
55  std::unique_ptr<PolynomialFit> _linear_logk;
56 };
std::unique_ptr< PolynomialFit > _linear_logk
Linear least-squares fit.
const std::vector< Real > & _logk_points
log(Keq) values at each temperature point
const std::vector< Real > & _temperature_points
Temperature points in data set (in K)
Equilibrium constant (in the form log10(Keq)) calculated using a least-squares fit to the data provid...
std::unique_ptr< EquilibriumConstantFit > _logk
Least-squares fit to data.
virtual Real computeValue() override
OutputTools< Real >::VariableValue VariableValue
EquilibriumConstantAux(const InputParameters &parameters)
DIE A HORRIBLE DEATH HERE typedef LIBMESH_DEFAULT_SCALAR_TYPE Real
static InputParameters validParams()
const InputParameters & parameters() const
const VariableValue & _temperature
Temperature (in K)