Cantera  3.1.0a1
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PDSS.cpp
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1/**
2 * @file PDSS.cpp
3 * Implementation of a pressure dependent standard state
4 * virtual function
5 * (see class @link Cantera::PDSS PDSS@endlink).
6 */
7
8// This file is part of Cantera. See License.txt in the top-level directory or
9// at https://cantera.org/license.txt for license and copyright information.
10
11#include "cantera/base/global.h"
12#include "cantera/thermo/PDSS.h"
14
15namespace Cantera
16{
17
18double PDSS::enthalpy_mole() const
19{
20 throw NotImplementedError("PDSS::enthalpy_mole");
21}
22
23double PDSS::enthalpy_RT() const
24{
25 throw NotImplementedError("PDSS::enthalpy_RT");
26}
27
29{
30 throw NotImplementedError("PDSS::intEnergy_mole");
31}
32
33double PDSS::entropy_mole() const
34{
35 throw NotImplementedError("PDSS::entropy_mole");
36}
37
38double PDSS::entropy_R() const
39{
40 throw NotImplementedError("PDSS::entropy_R");
41}
42
43double PDSS::gibbs_mole() const
44{
45 throw NotImplementedError("PDSS::gibbs_mole");
46}
47
48double PDSS::gibbs_RT() const
49{
50 throw NotImplementedError("PDSS::gibbs_RT");
51}
52
53double PDSS::cp_mole() const
54{
55 throw NotImplementedError("PDSS::cp_mole");
56}
57
58double PDSS::cp_R() const
59{
60 throw NotImplementedError("PDSS::cp_R");
61}
62
63double PDSS::molarVolume() const
64{
65 throw NotImplementedError("PDSS::molarVolume");
66}
67
68double PDSS::density() const
69{
70 throw NotImplementedError("PDSS::density");
71}
72
73double PDSS::cv_mole() const
74{
75 throw NotImplementedError("PDSS::cv_mole");
76}
77
78double PDSS::gibbs_RT_ref() const
79{
80 throw NotImplementedError("PDSS::gibbs_RT_ref");
81}
82
84{
85 throw NotImplementedError("PDSS::enthalpy_RT_ref");
86}
87
88double PDSS::entropy_R_ref() const
89{
90 throw NotImplementedError("PDSS::entropy_RT_ref");
91}
92
93double PDSS::cp_R_ref() const
94{
95 throw NotImplementedError("PDSS::entropy_RT_ref");
96}
97
99{
100 throw NotImplementedError("PDSS::molarVolume_ref");
101}
102
103double PDSS::pressure() const
104{
105 return m_pres;
106}
107
109{
110 throw NotImplementedError("PDSS::thermalExpansionCoeff");
111}
112
114{
115 throw NotImplementedError("PDSS::critTemperature");
116}
117
118double PDSS::critPressure() const
119{
120 throw NotImplementedError("PDSS::critPressure");
121}
122
123double PDSS::critDensity() const
124{
125 throw NotImplementedError("PDSS::critDensity");
126}
127
128void PDSS::setPressure(double pres)
129{
130 m_pres = pres;
131}
132
133double PDSS::temperature() const
134{
135 return m_temp;
136}
137
138void PDSS::setTemperature(double temp)
139{
140 m_temp = temp;
141}
142
144{
145 return m_mw;
146}
148{
149 m_mw = mw;
150}
151
152void PDSS::setState_TP(double temp, double pres)
153{
154 throw NotImplementedError("PDSS::setState_TP");
155}
156
157double PDSS::satPressure(double t)
158{
159 throw NotImplementedError("PDSS::satPressure");
160}
161
162// PDSS_Molar methods
163
165{
166 return enthalpy_mole() / (GasConstant * temperature());
167}
168
170{
171 return entropy_mole() / GasConstant;
172}
173
175{
176 return gibbs_mole() / (GasConstant * temperature());
177}
178
179double PDSS_Molar::cp_R() const
180{
181 return cp_mole() / GasConstant;
182}
183
184// PDSS_Nondimensional methods
185
186PDSS_Nondimensional::PDSS_Nondimensional()
187 : m_h0_RT(0.0)
188 , m_cp0_R(0.0)
189 , m_s0_R(0.0)
190 , m_g0_RT(0.0)
191 , m_V0(0.0)
192 , m_hss_RT(0.0)
193 , m_cpss_R(0.0)
194 , m_sss_R(0.0)
195 , m_gss_RT(0.0)
196 , m_Vss(0.0)
197{
198}
199
201{
202 return enthalpy_RT() * GasConstant * temperature();
203}
204
206{
207 return entropy_R() * GasConstant;
208}
209
211{
212 return gibbs_RT() * GasConstant * temperature();
213}
214
216{
217 return cp_R() * GasConstant;
218}
219
221{
222 return m_g0_RT;
223}
224
226{
227 return m_h0_RT;
228}
229
231{
232 return m_s0_R;
233}
234
236{
237 return m_cp0_R;
238}
239
241{
242 return m_V0;
243}
244
246{
247 return m_hss_RT;
248}
249
251{
252 return m_sss_R;
253}
254
256{
257 return m_gss_RT;
258}
259
261{
262 return m_cpss_R;
263}
264
266{
267 return m_Vss;
268}
269
271{
272 return m_mw / m_Vss;
273}
274
275}
Declarations for the virtual base class PDSS (pressure dependent standard state) which handles calcul...
Header file for a derived class of ThermoPhase that handles variable pressure standard state methods ...
An error indicating that an unimplemented function has been called.
double cp_R() const override
Return the molar const pressure heat capacity divided by RT.
Definition PDSS.cpp:179
double entropy_R() const override
Return the standard state entropy divided by RT.
Definition PDSS.cpp:169
double enthalpy_RT() const override
Return the standard state molar enthalpy divided by RT.
Definition PDSS.cpp:164
double gibbs_RT() const override
Return the molar Gibbs free energy divided by RT.
Definition PDSS.cpp:174
double molarVolume() const override
Return the molar volume at standard state.
Definition PDSS.cpp:265
double enthalpy_mole() const override
Return the molar enthalpy in units of J kmol-1.
Definition PDSS.cpp:200
double m_sss_R
Standard state entropy divided by R.
Definition PDSS.h:465
double gibbs_RT_ref() const override
Return the molar Gibbs free energy divided by RT at reference pressure.
Definition PDSS.cpp:220
double cp_R() const override
Return the molar const pressure heat capacity divided by RT.
Definition PDSS.cpp:260
double m_cpss_R
Standard state heat capacity divided by R.
Definition PDSS.h:464
double entropy_R_ref() const override
Return the molar entropy divided by R at reference pressure.
Definition PDSS.cpp:230
double enthalpy_RT_ref() const override
Return the molar enthalpy divided by RT at reference pressure.
Definition PDSS.cpp:225
double m_h0_RT
Reference state enthalpy divided by RT.
Definition PDSS.h:458
double m_g0_RT
Reference state Gibbs free energy divided by RT.
Definition PDSS.h:461
double m_s0_R
Reference state entropy divided by R.
Definition PDSS.h:460
double entropy_mole() const override
Return the molar entropy in units of J kmol-1 K-1.
Definition PDSS.cpp:205
double m_gss_RT
Standard state Gibbs free energy divided by RT.
Definition PDSS.h:466
double entropy_R() const override
Return the standard state entropy divided by RT.
Definition PDSS.cpp:250
double m_cp0_R
Reference state heat capacity divided by R.
Definition PDSS.h:459
double cp_mole() const override
Return the molar const pressure heat capacity in units of J kmol-1 K-1.
Definition PDSS.cpp:215
double enthalpy_RT() const override
Return the standard state molar enthalpy divided by RT.
Definition PDSS.cpp:245
double m_Vss
Standard State molar volume (m^3/kmol)
Definition PDSS.h:467
double density() const override
Return the standard state density at standard state.
Definition PDSS.cpp:270
double gibbs_mole() const override
Return the molar Gibbs free energy in units of J kmol-1.
Definition PDSS.cpp:210
double m_hss_RT
Standard state enthalpy divided by RT.
Definition PDSS.h:463
double molarVolume_ref() const override
Return the molar volume at reference pressure.
Definition PDSS.cpp:240
double gibbs_RT() const override
Return the molar Gibbs free energy divided by RT.
Definition PDSS.cpp:255
double m_V0
Reference state molar volume (m^3/kmol)
Definition PDSS.h:462
double cp_R_ref() const override
Return the molar heat capacity divided by R at reference pressure.
Definition PDSS.cpp:235
virtual double satPressure(double T)
saturation pressure
Definition PDSS.cpp:157
double molecularWeight() const
Return the molecular weight of the species in units of kg kmol-1.
Definition PDSS.cpp:143
virtual double cv_mole() const
Return the molar const volume heat capacity in units of J kmol-1 K-1.
Definition PDSS.cpp:73
virtual void setTemperature(double temp)
Set the internal temperature.
Definition PDSS.cpp:138
virtual double entropy_mole() const
Return the molar entropy in units of J kmol-1 K-1.
Definition PDSS.cpp:33
virtual double enthalpy_mole() const
Return the molar enthalpy in units of J kmol-1.
Definition PDSS.cpp:18
virtual double gibbs_RT() const
Return the molar Gibbs free energy divided by RT.
Definition PDSS.cpp:48
virtual double cp_R_ref() const
Return the molar heat capacity divided by R at reference pressure.
Definition PDSS.cpp:93
double m_temp
Current temperature used by the PDSS object.
Definition PDSS.h:398
virtual double density() const
Return the standard state density at standard state.
Definition PDSS.cpp:68
virtual double pressure() const
Returns the pressure (Pa)
Definition PDSS.cpp:103
void setMolecularWeight(double mw)
Set the molecular weight of the species.
Definition PDSS.cpp:147
virtual double cp_mole() const
Return the molar const pressure heat capacity in units of J kmol-1 K-1.
Definition PDSS.cpp:53
virtual double gibbs_mole() const
Return the molar Gibbs free energy in units of J kmol-1.
Definition PDSS.cpp:43
virtual double temperature() const
Return the current stored temperature.
Definition PDSS.cpp:133
virtual double entropy_R_ref() const
Return the molar entropy divided by R at reference pressure.
Definition PDSS.cpp:88
double m_pres
State of the system - pressure.
Definition PDSS.h:401
virtual double molarVolume_ref() const
Return the molar volume at reference pressure.
Definition PDSS.cpp:98
virtual double thermalExpansionCoeff() const
Return the volumetric thermal expansion coefficient. Units: 1/K.
Definition PDSS.cpp:108
virtual double enthalpy_RT() const
Return the standard state molar enthalpy divided by RT.
Definition PDSS.cpp:23
virtual double critDensity() const
critical density
Definition PDSS.cpp:123
virtual double enthalpy_RT_ref() const
Return the molar enthalpy divided by RT at reference pressure.
Definition PDSS.cpp:83
virtual double entropy_R() const
Return the standard state entropy divided by RT.
Definition PDSS.cpp:38
virtual double critTemperature() const
critical temperature
Definition PDSS.cpp:113
double m_mw
Molecular Weight of the species.
Definition PDSS.h:413
virtual double cp_R() const
Return the molar const pressure heat capacity divided by RT.
Definition PDSS.cpp:58
virtual double molarVolume() const
Return the molar volume at standard state.
Definition PDSS.cpp:63
virtual double intEnergy_mole() const
Return the molar internal Energy in units of J kmol-1.
Definition PDSS.cpp:28
virtual double critPressure() const
critical pressure
Definition PDSS.cpp:118
virtual void setPressure(double pres)
Sets the pressure in the object.
Definition PDSS.cpp:128
virtual double gibbs_RT_ref() const
Return the molar Gibbs free energy divided by RT at reference pressure.
Definition PDSS.cpp:78
virtual void setState_TP(double temp, double pres)
Set the internal temperature and pressure.
Definition PDSS.cpp:152
This file contains definitions for utility functions and text for modules, inputfiles and logging,...
const double GasConstant
Universal Gas Constant [J/kmol/K].
Definition ct_defs.h:120
Namespace for the Cantera kernel.
Definition AnyMap.cpp:564