CoolProp 7.1.0
An open-source fluid property and humid air property database
CoolProp-Tests.cpp
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1
2
3#include "AbstractState.h"
4#include "DataStructures.h"
5#include "../Backends/Helmholtz/HelmholtzEOSMixtureBackend.h"
6#include "../Backends/Helmholtz/HelmholtzEOSBackend.h"
8#include <map>
9
10// ############################################
11// TESTS
12// ############################################
13
14#if defined(ENABLE_CATCH)
15
17# include <catch2/catch_all.hpp>
18# include "CoolPropTools.h"
19# include "CoolProp.h"
20
21using namespace CoolProp;
22
23namespace TransportValidation {
24
25// A structure to hold the values for one validation call
26struct vel
27{
28 public:
29 std::string in1, in2, out, fluid;
30 double v1, v2, tol, expected;
31 vel(std::string fluid, std::string in1, double v1, std::string in2, double v2, std::string out, double expected, double tol) {
32 this->in1 = in1;
33 this->in2 = in2;
34 this->fluid = fluid;
35 this->v1 = v1;
36 this->v2 = v2;
37 this->expected = expected;
38 this->tol = tol;
39 };
40};
41
42vel viscosity_validation_data[] = {
43 // From Vogel, JPCRD, 1998
44 vel("Propane", "T", 90, "Dmolar", 16.52e3, "V", 7388e-6, 1e-3),
45 vel("Propane", "T", 150, "Dmolar", 15.14e3, "V", 656.9e-6, 5e-3),
46 vel("Propane", "T", 600, "Dmolar", 10.03e3, "V", 73.92e-6, 5e-3),
47 vel("Propane", "T", 280, "Dmolar", 11.78e3, "V", 117.4e-6, 1e-3),
48
49 // Huber, FPE, 2004
50 vel("n-Octane", "T", 300, "Dmolar", 6177.2, "V", 553.60e-6, 1e-3),
51 vel("n-Nonane", "T", 300, "Dmolar", 5619.1, "V", 709.53e-6, 1e-3),
52 vel("n-Decane", "T", 300, "Dmolar", 5150.4, "V", 926.44e-6, 1e-3),
53
54 // Huber, Energy & Fuels, 2004
55 vel("n-Dodecane", "T", 300, "Dmolar", 4411.5, "V", 1484.8e-6, 1e-3),
56 vel("n-Dodecane", "T", 500, "Dmolar", 3444.7, "V", 183.76e-6, 1e-3),
57
58 // Huber, I&ECR, 2006
59 vel("R125", "T", 300, "Dmolar", 10596.9998, "V", 177.37e-6, 1e-3),
60 vel("R125", "T", 400, "Dmolar", 30.631, "V", 17.070e-6, 1e-3),
61
62 // From REFPROP 9.1 since Huber I&ECR 2003 does not provide validation data
63 vel("R134a", "T", 185, "Q", 0, "V", 0.0012698376398294414, 1e-3),
64 vel("R134a", "T", 185, "Q", 1, "V", 7.4290821400170869e-006, 1e-3),
65 vel("R134a", "T", 360, "Q", 0, "V", 7.8146319978982133e-005, 1e-3),
66 vel("R134a", "T", 360, "Q", 1, "V", 1.7140264998576107e-005, 1e-3),
67
68 // From REFPROP 9.1 since Kiselev, IECR, 2005 does not provide validation data
69 vel("Ethanol", "T", 300, "Q", 0, "V", 0.0010439017679191723, 1e-3),
70 vel("Ethanol", "T", 300, "Q", 1, "V", 8.8293820936046416e-006, 1e-3),
71 vel("Ethanol", "T", 500, "Q", 0, "V", 6.0979347125450671e-005, 1e-3),
72 vel("Ethanol", "T", 500, "Q", 1, "V", 1.7229157141572511e-005, 1e-3),
73
74 // From CoolProp v5 implementation of correlation - more or less agrees with REFPROP
75 // Errata in BibTeX File
76 vel("Hydrogen", "T", 35, "Dmass", 100, "V", 5.47889e-005, 1e-3),
77
78 // From Meng 2012 experimental data (note erratum in BibTeX file)
79 vel("DimethylEther", "T", 253.146, "Dmass", 734.28, "V", 0.20444e-3, 3e-3),
80 vel("DimethylEther", "T", 373.132, "Dmass", 613.78, "V", 0.09991e-3, 3e-3),
81
82 // From Fenghour, JPCRD, 1995
83 vel("Ammonia", "T", 200, "Dmolar", 3.9, "V", 6.95e-6, 1e-3),
84 vel("Ammonia", "T", 200, "Dmolar", 42754.4, "V", 507.28e-6, 1e-3),
85 vel("Ammonia", "T", 398, "Dmolar", 7044.7, "V", 17.67e-6, 1e-3),
86 vel("Ammonia", "T", 398, "Dmolar", 21066.7, "V", 43.95e-6, 1e-3),
87
88 // From Lemmon and Jacobsen, JPCRD, 2004
89 vel("Nitrogen", "T", 100, "Dmolar", 1e-14, "V", 6.90349e-6, 1e-3),
90 vel("Nitrogen", "T", 300, "Dmolar", 1e-14, "V", 17.8771e-6, 1e-3),
91 vel("Nitrogen", "T", 100, "Dmolar", 25000, "V", 79.7418e-6, 1e-3),
92 vel("Nitrogen", "T", 200, "Dmolar", 10000, "V", 21.0810e-6, 1e-3),
93 vel("Nitrogen", "T", 300, "Dmolar", 5000, "V", 20.7430e-6, 1e-3),
94 vel("Nitrogen", "T", 126.195, "Dmolar", 11180, "V", 18.2978e-6, 1e-3),
95 vel("Argon", "T", 100, "Dmolar", 1e-14, "V", 8.18940e-6, 1e-3),
96 vel("Argon", "T", 300, "Dmolar", 1e-14, "V", 22.7241e-6, 1e-3),
97 vel("Argon", "T", 100, "Dmolar", 33000, "V", 184.232e-6, 1e-3),
98 vel("Argon", "T", 200, "Dmolar", 10000, "V", 25.5662e-6, 1e-3),
99 vel("Argon", "T", 300, "Dmolar", 5000, "V", 26.3706e-6, 1e-3),
100 vel("Argon", "T", 150.69, "Dmolar", 13400, "V", 27.6101e-6, 1e-3),
101 vel("Oxygen", "T", 100, "Dmolar", 1e-14, "V", 7.70243e-6, 1e-3),
102 vel("Oxygen", "T", 300, "Dmolar", 1e-14, "V", 20.6307e-6, 1e-3),
103 vel("Oxygen", "T", 100, "Dmolar", 35000, "V", 172.136e-6, 1e-3),
104 vel("Oxygen", "T", 200, "Dmolar", 10000, "V", 22.4445e-6, 1e-3),
105 vel("Oxygen", "T", 300, "Dmolar", 5000, "V", 23.7577e-6, 1e-3),
106 vel("Oxygen", "T", 154.6, "Dmolar", 13600, "V", 24.7898e-6, 1e-3),
107 vel("Air", "T", 100, "Dmolar", 1e-14, "V", 7.09559e-6, 1e-3),
108 vel("Air", "T", 300, "Dmolar", 1e-14, "V", 18.5230e-6, 1e-3),
109 vel("Air", "T", 100, "Dmolar", 28000, "V", 107.923e-6, 1e-3),
110 vel("Air", "T", 200, "Dmolar", 10000, "V", 21.1392e-6, 1e-3),
111 vel("Air", "T", 300, "Dmolar", 5000, "V", 21.3241e-6, 1e-3),
112 vel("Air", "T", 132.64, "Dmolar", 10400, "V", 17.7623e-6, 1e-3),
113
114 // From Michailidou, JPCRD, 2013
115 vel("Hexane", "T", 250, "Dmass", 1e-14, "V", 5.2584e-6, 1e-3),
116 vel("Hexane", "T", 400, "Dmass", 1e-14, "V", 8.4149e-6, 1e-3),
117 vel("Hexane", "T", 550, "Dmass", 1e-14, "V", 11.442e-6, 1e-3),
118 vel("Hexane", "T", 250, "Dmass", 700, "V", 528.2e-6, 1e-3),
119 vel("Hexane", "T", 400, "Dmass", 600, "V", 177.62e-6, 1e-3),
120 vel("Hexane", "T", 550, "Dmass", 500, "V", 95.002e-6, 1e-3),
121
122 // From Assael, JPCRD, 2014
123 vel("Heptane", "T", 250, "Dmass", 1e-14, "V", 4.9717e-6, 1e-3),
124 vel("Heptane", "T", 400, "Dmass", 1e-14, "V", 7.8361e-6, 1e-3),
125 vel("Heptane", "T", 550, "Dmass", 1e-14, "V", 10.7394e-6, 1e-3),
126 vel("Heptane", "T", 250, "Dmass", 720, "V", 725.69e-6, 1e-3),
127 vel("Heptane", "T", 400, "Dmass", 600, "V", 175.94e-6, 1e-3),
128 vel("Heptane", "T", 550, "Dmass", 500, "V", 95.105e-6, 1e-3),
129
130 // From Laesecke, JPCRD, 1998: https://pmc.ncbi.nlm.nih.gov/articles/PMC5514612/pdf/nihms869002.pdf
131 vel("CO2", "T", 100, "Dmass", 1e-5, "V", 0.0053757e-3, 1e-4),
132 vel("CO2", "T", 2000, "Dmass", 1e-5, "V", 0.066079e-3, 1e-4),
133 vel("CO2", "T", 10000, "Dmass", 1e-5, "V", 0.17620e-3, 1e-4),
134 vel("CO2", "T", 220, "Dmass", 3, "V", 0.011104e-3, 1e-4),
135 vel("CO2", "T", 225, "Dmass", 1150, "V", 0.22218e-3, 1e-4),
136 vel("CO2", "T", 300, "Dmass", 65, "V", 0.015563e-3, 1e-4),
137 vel("CO2", "T", 300, "Dmass", 1400, "V", 0.50594e-3, 1e-4),
138 vel("CO2", "T", 700, "Dmass", 100, "V", 0.033112e-3, 1e-4),
139 vel("CO2", "T", 700, "Dmass", 1200, "V", 0.22980e-3, 1e-4),
140
141 // Tanaka, IJT, 1996
142 vel("R123", "T", 265, "Dmass", 1545.8, "V", 627.1e-6, 1e-3),
143 vel("R123", "T", 265, "Dmass", 1.614, "V", 9.534e-6, 1e-3),
144 vel("R123", "T", 415, "Dmass", 1079.4, "V", 121.3e-6, 1e-3),
145 vel("R123", "T", 415, "Dmass", 118.9, "V", 15.82e-6, 1e-3),
146
147 // Huber, JPCRD, 2008 and IAPWS
148 vel("Water", "T", 298.15, "Dmass", 998, "V", 889.735100e-6, 1e-7),
149 vel("Water", "T", 298.15, "Dmass", 1200, "V", 1437.649467e-6, 1e-7),
150 vel("Water", "T", 373.15, "Dmass", 1000, "V", 307.883622e-6, 1e-7),
151 vel("Water", "T", 433.15, "Dmass", 1, "V", 14.538324e-6, 1e-7),
152 vel("Water", "T", 433.15, "Dmass", 1000, "V", 217.685358e-6, 1e-7),
153 vel("Water", "T", 873.15, "Dmass", 1, "V", 32.619287e-6, 1e-7),
154 vel("Water", "T", 873.15, "Dmass", 100, "V", 35.802262e-6, 1e-7),
155 vel("Water", "T", 873.15, "Dmass", 600, "V", 77.430195e-6, 1e-7),
156 vel("Water", "T", 1173.15, "Dmass", 1, "V", 44.217245e-6, 1e-7),
157 vel("Water", "T", 1173.15, "Dmass", 100, "V", 47.640433e-6, 1e-7),
158 vel("Water", "T", 1173.15, "Dmass", 400, "V", 64.154608e-6, 1e-7),
159 vel("Water", "T", 647.35, "Dmass", 122, "V", 25.520677e-6, 1e-7),
160 vel("Water", "T", 647.35, "Dmass", 222, "V", 31.337589e-6, 1e-7),
161 vel("Water", "T", 647.35, "Dmass", 272, "V", 36.228143e-6, 1e-7),
162 vel("Water", "T", 647.35, "Dmass", 322, "V", 42.961579e-6, 1e-7),
163 vel("Water", "T", 647.35, "Dmass", 372, "V", 45.688204e-6, 1e-7),
164 vel("Water", "T", 647.35, "Dmass", 422, "V", 49.436256e-6, 1e-7),
165
166 // Quinones-Cisneros, JPCRD, 2012
167 vel("SF6", "T", 300, "Dmass", 1e-14, "V", 15.2887e-6, 1e-4),
168 vel("SF6", "T", 300, "Dmass", 5.92, "V", 15.3043e-6, 1e-4),
169 vel("SF6", "T", 300, "Dmass", 1345.1, "V", 117.417e-6, 1e-4),
170 vel("SF6", "T", 400, "Dmass", 1e-14, "V", 19.6796e-6, 1e-4),
171 vel("SF6", "T", 400, "Dmass", 278.47, "V", 24.4272e-6, 1e-4),
172 vel("SF6", "T", 400, "Dmass", 1123.8, "V", 84.7835e-6, 1e-4),
173
174 // Quinones-Cisneros, JCED, 2012, data from validation
175 vel("H2S", "T", 200, "P", 1000e5, "V", 0.000460287, 1e-3),
176 vel("H2S", "T", 200, "P", 0.251702e5, "V", 8.02322E-06, 1e-3),
177 vel("H2S", "T", 596.961, "P", 1000e5, "V", 6.94741E-05, 1e-3),
178 vel("H2S", "T", 596.961, "P", 1e5, "V", 2.38654E-05, 1e-3),
179
180 // Geller, Purdue Conference, 2000
181 //vel("R410A", "T", 243.15, "Q", 0, "V", 238.61e-6, 5e-2),
182 //vel("R410A", "T", 243.15, "Q", 1, "V", 10.37e-6, 5e-2),
183 //vel("R410A", "T", 333.15, "Q", 0, "V", 70.71e-6, 5e-2),
184 //vel("R410A", "T", 333.15, "Q", 1, "V", 19.19e-6, 5e-2),
185 //vel("R407C", "T", 243.15, "Q", 0, "V", 304.18e-6, 1e-2),
186 //vel("R407C", "T", 243.15, "Q", 1, "V", 9.83e-6, 1e-2),
187 //vel("R407C", "T", 333.15, "Q", 0, "V", 95.96e-6, 1e-2),
188 //vel("R407C", "T", 333.15, "Q", 1, "V", 16.38e-6, 1e-2),
189 //vel("R404A", "T", 243.15, "Q", 0, "V", 264.67e-6, 1e-2),
190 //vel("R404A", "T", 243.15, "Q", 1, "V", 10.13e-6, 1e-2),
191 //vel("R404A", "T", 333.15, "Q", 0, "V", 73.92e-6, 1e-2),
192 //vel("R404A", "T", 333.15, "Q", 1, "V", 18.56e-6, 1e-2),
193 //vel("R507A", "T", 243.15, "Q", 0, "V", 284.59e-6, 3e-2),
194 //vel("R507A", "T", 243.15, "Q", 1, "V", 9.83e-6, 1e-2),
195 //vel("R507A", "T", 333.15, "Q", 0, "V", 74.37e-6, 1e-2),
196 //vel("R507A", "T", 333.15, "Q", 1, "V", 19.35e-6, 1e-2),
197
198 // From Arp, NIST, 1998
199 vel("Helium", "T", 3.6, "P", 0.180e6, "V", 3.745e-6, 1e-2),
200 vel("Helium", "T", 50, "P", 0.180e6, "V", 6.376e-6, 1e-2),
201 vel("Helium", "T", 400, "P", 0.180e6, "V", 24.29e-6, 1e-2),
202
203 // From Shan, ASHRAE, 2000
204 vel("R23", "T", 180, "Dmolar", 21097, "V", 353.88e-6, 1e-4),
205 vel("R23", "T", 420, "Dmolar", 7564, "V", 39.459e-6, 1e-4),
206 vel("R23", "T", 370, "Dmolar", 32.62, "V", 18.213e-6, 1e-4),
207
208 // From Friend, JPCRD, 1991
209 vel("Ethane", "T", 100, "Dmolar", 21330, "V", 878.6e-6, 1e-2),
210 vel("Ethane", "T", 430, "Dmolar", 12780, "V", 58.70e-6, 1e-2),
211 vel("Ethane", "T", 500, "Dmolar", 11210, "V", 48.34e-6, 1e-2),
212
213 // From Xiang, JPCRD, 2006
214 vel("Methanol", "T", 300, "Dmass", 0.12955, "V", 0.009696e-3, 1e-3),
215 vel("Methanol", "T", 300, "Dmass", 788.41, "V", 0.5422e-3, 1e-3),
216 vel("Methanol", "T", 630, "Dmass", 0.061183, "V", 0.02081e-3, 1e-3),
217 vel("Methanol", "T", 630, "Dmass", 888.50, "V", 0.2405e-3, 1e-1), // They use a different EOS in the high pressure region
218
219 // From REFPROP 9.1 since no data provided
220 vel("n-Butane", "T", 150, "Q", 0, "V", 0.0013697657668, 1e-4),
221 vel("n-Butane", "T", 400, "Q", 1, "V", 1.2027464524762453e-005, 1e-4),
222 vel("IsoButane", "T", 120, "Q", 0, "V", 0.0060558450757844271, 1e-4),
223 vel("IsoButane", "T", 400, "Q", 1, "V", 1.4761041187617117e-005, 2e-4),
224 vel("R134a", "T", 175, "Q", 0, "V", 0.0017558494524138289, 1e-4),
225 vel("R134a", "T", 360, "Q", 1, "V", 1.7140264998576107e-005, 1e-4),
226
227 // From Tariq, JPCRD, 2014
228 vel("Cyclohexane", "T", 300, "Dmolar", 1e-10, "V", 7.058e-6, 1e-4),
229 vel("Cyclohexane", "T", 300, "Dmolar", 0.0430e3, "V", 6.977e-6, 1e-4),
230 vel("Cyclohexane", "T", 300, "Dmolar", 9.1756e3, "V", 863.66e-6, 1e-4),
231 vel("Cyclohexane", "T", 300, "Dmolar", 9.9508e3, "V", 2850.18e-6, 1e-4),
232 vel("Cyclohexane", "T", 500, "Dmolar", 1e-10, "V", 11.189e-6, 1e-4),
233 vel("Cyclohexane", "T", 500, "Dmolar", 6.0213e3, "V", 94.842e-6, 1e-4),
234 vel("Cyclohexane", "T", 500, "Dmolar", 8.5915e3, "V", 380.04e-6, 1e-4),
235 vel("Cyclohexane", "T", 700, "Dmolar", 1e-10, "V", 15.093e-6, 1e-4),
236 vel("Cyclohexane", "T", 700, "Dmolar", 7.4765e3, "V", 176.749e-6, 1e-4),
237
238 // From Avgeri, JPCRD, 2014
239 vel("Benzene", "T", 300, "Dmass", 1e-10, "V", 7.625e-6, 1e-4),
240 vel("Benzene", "T", 400, "Dmass", 1e-10, "V", 10.102e-6, 1e-4),
241 vel("Benzene", "T", 550, "Dmass", 1e-10, "V", 13.790e-6, 1e-4),
242 vel("Benzene", "T", 300, "Dmass", 875, "V", 608.52e-6, 1e-4),
243 vel("Benzene", "T", 400, "Dmass", 760, "V", 211.74e-6, 1e-4),
244 vel("Benzene", "T", 550, "Dmass", 500, "V", 60.511e-6, 1e-4),
245
246 // From Cao, JPCRD, 2016
247 vel("m-Xylene", "T", 300, "Dmolar", 1e-10, "V", 6.637e-6, 1e-4),
248 vel("m-Xylene", "T", 300, "Dmolar", 0.04 * 1e3, "V", 6.564e-6, 1e-4),
249 vel("m-Xylene", "T", 300, "Dmolar", 8.0849 * 1e3, "V", 569.680e-6, 1e-4),
250 vel("m-Xylene", "T", 300, "Dmolar", 8.9421 * 1e3, "V", 1898.841e-6, 1e-4),
251 vel("m-Xylene", "T", 400, "Dmolar", 1e-10, "V", 8.616e-6, 1e-4),
252 vel("m-Xylene", "T", 400, "Dmolar", 0.04 * 1e3, "V", 8.585e-6, 1e-4),
253 vel("m-Xylene", "T", 400, "Dmolar", 7.2282 * 1e3, "V", 238.785e-6, 1e-4),
254 vel("m-Xylene", "T", 400, "Dmolar", 8.4734 * 1e3, "V", 718.950e-6, 1e-4),
255 vel("m-Xylene", "T", 600, "Dmolar", 1e-10, "V", 12.841e-6, 1e-4),
256 vel("m-Xylene", "T", 600, "Dmolar", 0.04 * 1e3, "V", 12.936e-6, 1e-4),
257 vel("m-Xylene", "T", 600, "Dmolar", 7.6591 * 1e3, "V", 299.164e-6, 1e-4),
258
259 // From Cao, JPCRD, 2016
260 vel("o-Xylene", "T", 300, "Dmolar", 1e-10, "V", 6.670e-6, 1e-4),
261 vel("o-Xylene", "T", 300, "Dmolar", 0.04 * 1e3, "V", 6.598e-6, 1e-4),
262 vel("o-Xylene", "T", 300, "Dmolar", 8.2369 * 1e3, "V", 738.286e-6, 1e-4),
263 vel("o-Xylene", "T", 300, "Dmolar", 8.7845 * 1e3, "V", 1645.436e-6, 1e-4),
264 vel("o-Xylene", "T", 400, "Dmolar", 1e-10, "V", 8.658e-6, 1e-4),
265 vel("o-Xylene", "T", 400, "Dmolar", 0.04 * 1e3, "V", 8.634e-6, 1e-4),
266 vel("o-Xylene", "T", 400, "Dmolar", 7.4060 * 1e3, "V", 279.954e-6, 1e-4),
267 vel("o-Xylene", "T", 400, "Dmolar", 8.2291 * 1e3, "V", 595.652e-6, 1e-4),
268 vel("o-Xylene", "T", 600, "Dmolar", 1e-10, "V", 12.904e-6, 1e-4),
269 vel("o-Xylene", "T", 600, "Dmolar", 0.04 * 1e3, "V", 13.018e-6, 1e-4),
270 vel("o-Xylene", "T", 600, "Dmolar", 7.2408 * 1e3, "V", 253.530e-6, 1e-4),
271
272 // From Balogun, JPCRD, 2016
273 vel("p-Xylene", "T", 300, "Dmolar", 1e-10, "V", 6.604e-6, 1e-4),
274 vel("p-Xylene", "T", 300, "Dmolar", 0.049 * 1e3, "V", 6.405e-6, 1e-4),
275 vel("p-Xylene", "T", 300, "Dmolar", 8.0548 * 1e3, "V", 593.272e-6, 1e-4),
276 vel("p-Xylene", "T", 300, "Dmolar", 8.6309 * 1e3, "V", 1266.337e-6, 1e-4),
277 vel("p-Xylene", "T", 400, "Dmolar", 1e-10, "V", 8.573e-6, 1e-4),
278 vel("p-Xylene", "T", 400, "Dmolar", 7.1995 * 1e3, "V", 239.202e-6, 1e-4),
279 vel("p-Xylene", "T", 400, "Dmolar", 8.0735 * 1e3, "V", 484.512e-6, 1e-4),
280 vel("p-Xylene", "T", 600, "Dmolar", 1e-10, "V", 12.777e-6, 1e-4),
281 vel("p-Xylene", "T", 600, "Dmolar", 7.0985 * 1e3, "V", 209.151e-6, 1e-4),
282
283 // From Mylona, JPCRD, 2014
284 vel("EthylBenzene", "T", 617, "Dmass", 316, "V", 33.22e-6, 1e-2),
285
286 // Heavy Water, IAPWS formulation
287 vel("HeavyWater", "T", 0.5000 * 643.847, "Dmass", 3.07 * 358, "V", 12.0604912273 * 55.2651e-6, 1e-5),
288 vel("HeavyWater", "T", 0.9000 * 643.847, "Dmass", 2.16 * 358, "V", 1.6561616211 * 55.2651e-6, 1e-5),
289 vel("HeavyWater", "T", 1.2000 * 643.847, "Dmass", 0.8 * 358, "V", 0.7651099154 * 55.2651e-6, 1e-5),
290
291 // Toluene, Avgeri, JPCRD, 2015
292 vel("Toluene", "T", 300, "Dmass", 1e-10, "V", 7.023e-6, 1e-4),
293 vel("Toluene", "T", 400, "Dmass", 1e-10, "V", 9.243e-6, 1e-4),
294 vel("Toluene", "T", 550, "Dmass", 1e-10, "V", 12.607e-6, 1e-4),
295 vel("Toluene", "T", 300, "Dmass", 865, "V", 566.78e-6, 1e-4),
296 vel("Toluene", "T", 400, "Dmass", 770, "V", 232.75e-6, 1e-4),
297 vel("Toluene", "T", 550, "Dmass", 550, "V", 80.267e-6, 1e-4),
298
299};
300
301class TransportValidationFixture
302{
303 protected:
304 CoolPropDbl actual, x1, x2;
305 shared_ptr<CoolProp::AbstractState> pState;
307
308 public:
309 TransportValidationFixture() {}
310 ~TransportValidationFixture() {}
311 void set_backend(std::string backend, std::string fluid_name) {
312 pState.reset(CoolProp::AbstractState::factory(backend, fluid_name));
313 }
314 void set_pair(std::string& in1, double v1, std::string& in2, double v2) {
315 double o1, o2;
318 CoolProp::input_pairs pair = CoolProp::generate_update_pair(iin1, v1, iin2, v2, o1, o2);
319 pState->update(pair, o1, o2);
320 }
321 void get_value(parameters key) {
322 actual = pState->keyed_output(key);
323 }
324};
325
326TEST_CASE_METHOD(TransportValidationFixture, "Compare viscosities against published data", "[viscosity],[transport]") {
327 int inputsN = sizeof(viscosity_validation_data) / sizeof(viscosity_validation_data[0]);
328 for (int i = 0; i < inputsN; ++i) {
329 vel el = viscosity_validation_data[i];
330 CHECK_NOTHROW(set_backend("HEOS", el.fluid));
331
332 CAPTURE(el.fluid);
333 CAPTURE(el.in1);
334 CAPTURE(el.v1);
335 CAPTURE(el.in2);
336 CAPTURE(el.v2);
337 CHECK_NOTHROW(set_pair(el.in1, el.v1, el.in2, el.v2));
338 CHECK_NOTHROW(get_value(CoolProp::iviscosity));
339 CAPTURE(el.expected);
340 CAPTURE(actual);
341 CHECK(std::abs(actual / el.expected - 1) < el.tol);
342 }
343}
344
345vel conductivity_validation_data[] = {
347
348 // From Assael, JPCRD, 2013
349 vel("Hexane", "T", 250, "Dmass", 700, "L", 137.62e-3, 1e-4),
350 vel("Hexane", "T", 400, "Dmass", 2, "L", 23.558e-3, 1e-4),
351 vel("Hexane", "T", 400, "Dmass", 650, "L", 129.28e-3, 3e-4),
352 vel("Hexane", "T", 510, "Dmass", 2, "L", 36.772e-3, 1e-4),
353
354 // From Assael, JPCRD, 2013
355 vel("Heptane", "T", 250, "Dmass", 720, "L", 137.09e-3, 1e-4),
356 vel("Heptane", "T", 400, "Dmass", 2, "L", 21.794e-3, 1e-4),
357 vel("Heptane", "T", 400, "Dmass", 650, "L", 120.75e-3, 1e-4),
358 vel("Heptane", "T", 535, "Dmass", 100, "L", 51.655e-3, 3e-3), // Relaxed tolerance because conductivity was fit using older viscosity correlation
359
360 // From Assael, JPCRD, 2013
361 vel("Ethanol", "T", 300, "Dmass", 850, "L", 209.68e-3, 1e-4),
362 vel("Ethanol", "T", 400, "Dmass", 2, "L", 26.108e-3, 1e-4),
363 vel("Ethanol", "T", 400, "Dmass", 690, "L", 149.21e-3, 1e-4),
364 vel("Ethanol", "T", 500, "Dmass", 10, "L", 39.594e-3, 1e-4),
365
367 //vel("Toluene", "T", 298.15, "Dmass", 1e-15, "L", 10.749e-3, 1e-4),
368 //vel("Toluene", "T", 298.15, "Dmass", 862.948, "L", 130.66e-3, 1e-4),
369 //vel("Toluene", "T", 298.15, "Dmass", 876.804, "L", 136.70e-3, 1e-4),
370 //vel("Toluene", "T", 595, "Dmass", 1e-15, "L", 40.538e-3, 1e-4),
371 //vel("Toluene", "T", 595, "Dmass", 46.512, "L", 41.549e-3, 1e-4),
372 //vel("Toluene", "T", 185, "Dmass", 1e-15, "L", 4.3758e-3, 1e-4),
373 //vel("Toluene", "T", 185, "Dmass", 968.821, "L", 158.24e-3, 1e-4),
374
375 // From Assael, JPCRD, 2012
376 vel("SF6", "T", 298.15, "Dmass", 1e-13, "L", 12.952e-3, 1e-4),
377 vel("SF6", "T", 298.15, "Dmass", 100, "L", 14.126e-3, 1e-4),
378 vel("SF6", "T", 298.15, "Dmass", 1600, "L", 69.729e-3, 1e-4),
379 vel("SF6", "T", 310, "Dmass", 1e-13, "L", 13.834e-3, 1e-4),
380 vel("SF6", "T", 310, "Dmass", 1200, "L", 48.705e-3, 1e-4),
381 vel("SF6", "T", 480, "Dmass", 100, "L", 28.847e-3, 1e-4),
382
384 //vel("Benzene", "T", 290, "Dmass", 890, "L", 147.66e-3, 1e-4),
385 //vel("Benzene", "T", 500, "Dmass", 2, "L", 30.174e-3, 1e-4),
386 //vel("Benzene", "T", 500, "Dmass", 32, "L", 32.175e-3, 1e-4),
387 //vel("Benzene", "T", 500, "Dmass", 800, "L", 141.24e-3, 1e-4),
388 //vel("Benzene", "T", 575, "Dmass", 1.7, "L", 37.763e-3, 1e-4),
389
390 // From Assael, JPCRD, 2011
391 vel("Hydrogen", "T", 298.15, "Dmass", 1e-13, "L", 185.67e-3, 1e-4),
392 vel("Hydrogen", "T", 298.15, "Dmass", 0.80844, "L", 186.97e-3, 1e-4),
393 vel("Hydrogen", "T", 298.15, "Dmass", 14.4813, "L", 201.35e-3, 1e-4),
394 vel("Hydrogen", "T", 35, "Dmass", 1e-13, "L", 26.988e-3, 1e-4),
395 vel("Hydrogen", "T", 35, "Dmass", 30, "L", 0.0770177, 1e-4), // Updated since Assael uses a different viscosity correlation
396 vel("Hydrogen", "T", 18, "Dmass", 1e-13, "L", 13.875e-3, 1e-4),
397 vel("Hydrogen", "T", 18, "Dmass", 75, "L", 104.48e-3, 1e-4),
398 /*vel("ParaHydrogen", "T", 298.15, "Dmass", 1e-13, "L", 192.38e-3, 1e-4),
399vel("ParaHydrogen", "T", 298.15, "Dmass", 0.80844, "L", 192.81e-3, 1e-4),
400vel("ParaHydrogen", "T", 298.15, "Dmass", 14.4813, "L", 207.85e-3, 1e-4),
401vel("ParaHydrogen", "T", 35, "Dmass", 1e-13, "L", 27.222e-3, 1e-4),
402vel("ParaHydrogen", "T", 35, "Dmass", 30, "L", 70.335e-3, 1e-4),
403vel("ParaHydrogen", "T", 18, "Dmass", 1e-13, "L", 13.643e-3, 1e-4),
404vel("ParaHydrogen", "T", 18, "Dmass", 75, "L", 100.52e-3, 1e-4),*/
405
406 // Some of these don't work
407 vel("R125", "T", 341, "Dmass", 600, "L", 0.0565642978494, 2e-4),
408 vel("R125", "T", 200, "Dmass", 1e-13, "L", 0.007036843623086, 2e-4),
409 vel("IsoButane", "T", 390, "Dmass", 387.09520158645068, "L", 0.063039, 2e-4),
410 vel("IsoButane", "T", 390, "Dmass", 85.76703973869482, "L", 0.036603, 2e-4),
411 vel("n-Butane", "T", 415, "Dmass", 360.01895129934866, "L", 0.067045, 2e-4),
412 vel("n-Butane", "T", 415, "Dmass", 110.3113177144, "L", 0.044449, 1e-4),
413
414 // From Huber, FPE, 2005
415 vel("n-Octane", "T", 300, "Dmolar", 6177.2, "L", 0.12836, 1e-4),
416 vel("n-Nonane", "T", 300, "Dmolar", 5619.4, "L", 0.13031, 1e-4),
417 //vel("n-Decane", "T", 300, "Dmass", 5150.4, "L", 0.13280, 1e-4), // no viscosity
418
419 // From Huber, EF, 2004
420 vel("n-Dodecane", "T", 300, "Dmolar", 4411.5, "L", 0.13829, 1e-4),
421 vel("n-Dodecane", "T", 500, "Dmolar", 3444.7, "L", 0.09384, 1e-4),
422 vel("n-Dodecane", "T", 660, "Dmolar", 1500.98, "L", 0.090346, 1e-4),
423
424 // From REFPROP 9.1 since no data provided in Marsh, 2002
425 vel("n-Propane", "T", 368, "Q", 0, "L", 0.07282154952457, 1e-3),
426 vel("n-Propane", "T", 368, "Dmolar", 1e-10, "L", 0.0266135388745317, 1e-4),
427
428 // From Perkins, JCED, 2011
429 //vel("R1234yf", "T", 250, "Dmass", 2.80006, "L", 0.0098481, 1e-4),
430 //vel("R1234yf", "T", 300, "Dmass", 4.671556, "L", 0.013996, 1e-4),
431 //vel("R1234yf", "T", 250, "Dmass", 1299.50, "L", 0.088574, 1e-4),
432 //vel("R1234yf", "T", 300, "Dmass", 1182.05, "L", 0.075245, 1e-4),
433 //vel("R1234ze(E)", "T", 250, "Dmass", 2.80451, "L", 0.0098503, 1e-4),
434 //vel("R1234ze(E)", "T", 300, "Dmass", 4.67948, "L", 0.013933, 1e-4),
435 //vel("R1234ze(E)", "T", 250, "Dmass", 1349.37, "L", 0.10066, 1e-4),
436 //vel("R1234ze(E)", "T", 300, "Dmass", 1233.82, "L", 0.085389, 1e-4),
437
438 // From Laesecke, IJR 1995
439 vel("R123", "T", 180, "Dmass", 1739, "L", 110.9e-3, 2e-4),
440 vel("R123", "T", 180, "Dmass", 0.2873e-2, "L", 2.473e-3, 1e-3),
441 vel("R123", "T", 430, "Dmass", 996.35, "L", 45.62e-3, 1e-3),
442 vel("R123", "T", 430, "Dmass", 166.9, "L", 21.03e-3, 1e-3),
443
444 // From Huber, JPCRD, 2016
445 vel("CO2", "T", 250.0, "Dmass", 1e-6, "L", 12.99e-3, 1e-3),
446 vel("CO2", "T", 250.0, "Dmass", 2.0, "L", 13.05e-3, 1e-3),
447 vel("CO2", "T", 250.0, "Dmass", 1058.0, "L", 140.00e-3, 1e-4),
448 vel("CO2", "T", 310.0, "Dmass", 400.0, "L", 73.04e-3, 1e-4),
449
450 // From Friend, JPCRD, 1991
451 vel("Ethane", "T", 100, "Dmass", 1e-13, "L", 3.46e-3, 1e-2),
452 vel("Ethane", "T", 230, "Dmolar", 16020, "L", 126.2e-3, 1e-2),
453 vel("Ethane", "T", 440, "Dmolar", 1520, "L", 45.9e-3, 1e-2),
454 vel("Ethane", "T", 310, "Dmolar", 4130, "L", 45.4e-3, 1e-2),
455
456 // From Lemmon and Jacobsen, JPCRD, 2004
457 vel("Nitrogen", "T", 100, "Dmolar", 1e-14, "L", 9.27749e-3, 1e-4),
458 vel("Nitrogen", "T", 300, "Dmolar", 1e-14, "L", 25.9361e-3, 1e-4),
459 vel("Nitrogen", "T", 100, "Dmolar", 25000, "L", 103.834e-3, 1e-4),
460 vel("Nitrogen", "T", 200, "Dmolar", 10000, "L", 36.0099e-3, 1e-4),
461 vel("Nitrogen", "T", 300, "Dmolar", 5000, "L", 32.7694e-3, 1e-4),
462 vel("Nitrogen", "T", 126.195, "Dmolar", 11180, "L", 675.800e-3, 1e-4),
463 vel("Argon", "T", 100, "Dmolar", 1e-14, "L", 6.36587e-3, 1e-4),
464 vel("Argon", "T", 300, "Dmolar", 1e-14, "L", 17.8042e-3, 1e-4),
465 vel("Argon", "T", 100, "Dmolar", 33000, "L", 111.266e-3, 1e-4),
466 vel("Argon", "T", 200, "Dmolar", 10000, "L", 26.1377e-3, 1e-4),
467 vel("Argon", "T", 300, "Dmolar", 5000, "L", 23.2302e-3, 1e-4),
468 vel("Argon", "T", 150.69, "Dmolar", 13400, "L", 856.793e-3, 1e-4),
469 vel("Oxygen", "T", 100, "Dmolar", 1e-14, "L", 8.94334e-3, 1e-4),
470 vel("Oxygen", "T", 300, "Dmolar", 1e-14, "L", 26.4403e-3, 1e-4),
471 vel("Oxygen", "T", 100, "Dmolar", 35000, "L", 146.044e-3, 1e-4),
472 vel("Oxygen", "T", 200, "Dmolar", 10000, "L", 34.6124e-3, 1e-4),
473 vel("Oxygen", "T", 300, "Dmolar", 5000, "L", 32.5491e-3, 1e-4),
474 vel("Oxygen", "T", 154.6, "Dmolar", 13600, "L", 377.476e-3, 1e-4),
475 vel("Air", "T", 100, "Dmolar", 1e-14, "L", 9.35902e-3, 1e-4),
476 vel("Air", "T", 300, "Dmolar", 1e-14, "L", 26.3529e-3, 1e-4),
477 vel("Air", "T", 100, "Dmolar", 28000, "L", 119.221e-3, 1e-4),
478 vel("Air", "T", 200, "Dmolar", 10000, "L", 35.3185e-3, 1e-4),
479 vel("Air", "T", 300, "Dmolar", 5000, "L", 32.6062e-3, 1e-4),
480 vel("Air", "T", 132.64, "Dmolar", 10400, "L", 75.6231e-3, 1e-4),
481
482 // Huber, JPCRD, 2012
483 vel("Water", "T", 298.15, "Dmass", 1e-14, "L", 18.4341883e-3, 1e-6),
484 vel("Water", "T", 298.15, "Dmass", 998, "L", 607.712868e-3, 1e-6),
485 vel("Water", "T", 298.15, "Dmass", 1200, "L", 799.038144e-3, 1e-6),
486 vel("Water", "T", 873.15, "Dmass", 1e-14, "L", 79.1034659e-3, 1e-6),
487 vel("Water", "T", 647.35, "Dmass", 1, "L", 51.9298924e-3, 1e-6),
488 vel("Water", "T", 647.35, "Dmass", 122, "L", 130.922885e-3, 2e-4),
489 vel("Water", "T", 647.35, "Dmass", 222, "L", 367.787459e-3, 2e-4),
490 vel("Water", "T", 647.35, "Dmass", 272, "L", 757.959776e-3, 2e-4),
491 vel("Water", "T", 647.35, "Dmass", 322, "L", 1443.75556e-3, 2e-4),
492 vel("Water", "T", 647.35, "Dmass", 372, "L", 650.319402e-3, 2e-4),
493 vel("Water", "T", 647.35, "Dmass", 422, "L", 448.883487e-3, 2e-4),
494 vel("Water", "T", 647.35, "Dmass", 750, "L", 600.961346e-3, 2e-4),
495
496 // From Shan, ASHRAE, 2000
497 vel("R23", "T", 180, "Dmolar", 21097, "L", 143.19e-3, 1e-4),
498 vel("R23", "T", 420, "Dmolar", 7564, "L", 50.19e-3, 2e-4),
499 vel("R23", "T", 370, "Dmolar", 32.62, "L", 17.455e-3, 1e-4),
500
501 // From REFPROP 9.1 since no sample data provided in Tufeu
502 vel("Ammonia", "T", 310, "Dmolar", 34320, "L", 0.45223303481784971, 1e-4),
503 vel("Ammonia", "T", 395, "Q", 0, "L", 0.2264480769301, 2e-3),
504
505 // From Hands, Cryogenics, 1981
506 vel("Helium", "T", 800, "P", 1e5, "L", 0.3085, 1e-2),
507 vel("Helium", "T", 300, "P", 1e5, "L", 0.1560, 1e-2),
508 vel("Helium", "T", 20, "P", 1e5, "L", 0.0262, 1e-2),
509 vel("Helium", "T", 8, "P", 1e5, "L", 0.0145, 1e-2),
510 vel("Helium", "T", 4, "P", 20e5, "L", 0.0255, 1e-2),
511 vel("Helium", "T", 8, "P", 20e5, "L", 0.0308, 1e-2),
512 vel("Helium", "T", 20, "P", 20e5, "L", 0.0328, 1e-2),
513 vel("Helium", "T", 4, "P", 100e5, "L", 0.0385, 3e-2),
514 vel("Helium", "T", 8, "P", 100e5, "L", 0.0566, 3e-2),
515 vel("Helium", "T", 20, "P", 100e5, "L", 0.0594, 1e-2),
516 vel("Helium", "T", 4, "P", 1e5, "L", 0.0186, 1e-2),
517 vel("Helium", "T", 4, "P", 2e5, "L", 0.0194, 1e-2),
518 vel("Helium", "T", 5.180, "P", 2.3e5, "L", 0.0195, 1e-1),
519 vel("Helium", "T", 5.2, "P", 2.3e5, "L", 0.0202, 1e-1),
520 vel("Helium", "T", 5.230, "P", 2.3e5, "L", 0.0181, 1e-1),
521 vel("Helium", "T", 5.260, "P", 2.3e5, "L", 0.0159, 1e-1),
522 vel("Helium", "T", 5.3, "P", 2.3e5, "L", 0.0149, 1e-1),
523
524 // Geller, IJT, 2001 - based on experimental data, no validation data provided
525 //vel("R404A", "T", 253.03, "P", 0.101e6, "L", 0.00991, 0.03),
526 //vel("R404A", "T", 334.38, "P", 2.176e6, "L", 19.93e-3, 0.03),
527 //vel("R407C", "T", 253.45, "P", 0.101e6, "L", 0.00970, 0.03),
528 //vel("R407C", "T", 314.39, "P", 0.458e6, "L", 14.87e-3, 0.03),
529 //vel("R410A", "T", 260.32, "P", 0.101e6, "L", 0.01043, 0.03),
530 //vel("R410A", "T", 332.09, "P", 3.690e6, "L", 22.76e-3, 0.03),
531 //vel("R507A", "T", 254.85, "P", 0.101e6, "L", 0.01007, 0.03),
532 //vel("R507A", "T", 333.18, "P", 2.644e6, "L", 21.31e-3, 0.03),
533
534 // From REFPROP 9.1 since no data provided
535 vel("R134a", "T", 240, "D", 1e-10, "L", 0.008698768, 1e-4),
536 vel("R134a", "T", 330, "D", 1e-10, "L", 0.015907606, 1e-4),
537 vel("R134a", "T", 330, "Q", 0, "L", 0.06746432253, 1e-4),
538 vel("R134a", "T", 240, "Q", 1, "L", 0.00873242359, 1e-4),
539
540 // Mylona, JPCRD, 2014 - dense check values taken from the implementation in REFPROP 10.0
541 vel("o-Xylene", "T", 635, "D", 270, "L", 0.10387803232507065, 5e-3),
542 vel("m-Xylene", "T", 616, "D", 220, "L", 0.10330950977360005, 5e-3),
543 vel("p-Xylene", "T", 620, "D", 287, "L", 0.09804128875928533, 5e-3),
544 vel("EthylBenzene", "T", 617, "D", 316, "L", 0.1479194493736235, 5e-2),
545 // dilute values
546 vel("o-Xylene", "T", 300, "D", 1e-12, "L", 13.68e-3, 1e-3),
547 vel("o-Xylene", "T", 600, "D", 1e-12, "L", 41.6e-3, 1e-3),
548 vel("m-Xylene", "T", 300, "D", 1e-12, "L", 9.45e-3, 1e-3),
549 vel("m-Xylene", "T", 600, "D", 1e-12, "L", 40.6e-3, 1e-3),
550 vel("p-Xylene", "T", 300, "D", 1e-12, "L", 10.57e-3, 1e-3),
551 vel("p-Xylene", "T", 600, "D", 1e-12, "L", 41.73e-3, 1e-3),
552 vel("EthylBenzene", "T", 300, "D", 1e-12, "L", 9.71e-3, 1e-3),
553 vel("EthylBenzene", "T", 600, "D", 1e-12, "L", 41.14e-3, 1e-3),
554
555 // Friend, JPCRD, 1989
556 vel("Methane", "T", 100, "D", 1e-12, "L", 9.83e-3, 1e-3),
557 vel("Methane", "T", 400, "D", 1e-12, "L", 49.96e-3, 1e-3),
558 vel("Methane", "T", 182, "Q", 0, "L", 82.5e-3, 5e-3),
559 vel("Methane", "T", 100, "Dmolar", 28.8e3, "L", 234e-3, 1e-2),
560
561 // Sykioti, JPCRD, 2013
562 vel("Methanol", "T", 300, "Dmass", 850, "L", 241.48e-3, 1e-2),
563 vel("Methanol", "T", 400, "Dmass", 2, "L", 25.803e-3, 1e-2),
564 vel("Methanol", "T", 400, "Dmass", 690, "L", 183.59e-3, 1e-2),
565 vel("Methanol", "T", 500, "Dmass", 10, "L", 40.495e-3, 1e-2),
566
567 // Heavy Water, IAPWS formulation
568 vel("HeavyWater", "T", 0.5000 * 643.847, "Dmass", 3.07 * 358, "V", 835.786416818 * 0.742128e-3, 1e-5),
569 vel("HeavyWater", "T", 0.9000 * 643.847, "Dmass", 2.16 * 358, "V", 627.777590127 * 0.742128e-3, 1e-5),
570 vel("HeavyWater", "T", 1.2000 * 643.847, "Dmass", 0.8 * 358, "V", 259.605241187 * 0.742128e-3, 1e-5),
571
572 // Vassiliou, JPCRD, 2015
573 vel("Cyclopentane", "T", 512, "Dmass", 1e-12, "L", 37.042e-3, 1e-5),
574 vel("Cyclopentane", "T", 512, "Dmass", 400, "L", 69.698e-3, 1e-1),
575 vel("Isopentane", "T", 460, "Dmass", 1e-12, "L", 35.883e-3, 1e-4),
576 vel("Isopentane", "T", 460, "Dmass", 329.914, "L", 59.649e-3, 1e-1),
577 vel("n-Pentane", "T", 460, "Dmass", 1e-12, "L", 34.048e-3, 1e-5),
578 vel("n-Pentane", "T", 460, "Dmass", 377.687, "L", 71.300e-3, 1e-1),
579};
580
581TEST_CASE_METHOD(TransportValidationFixture, "Compare thermal conductivities against published data", "[conductivity],[transport]") {
582 int inputsN = sizeof(conductivity_validation_data) / sizeof(conductivity_validation_data[0]);
583 for (int i = 0; i < inputsN; ++i) {
584 vel el = conductivity_validation_data[i];
585 CHECK_NOTHROW(set_backend("HEOS", el.fluid));
586 CAPTURE(el.fluid);
587 CAPTURE(el.in1);
588 CAPTURE(el.v1);
589 CAPTURE(el.in2);
590 CAPTURE(el.v2);
591 CHECK_NOTHROW(set_pair(el.in1, el.v1, el.in2, el.v2));
592 get_value(CoolProp::iconductivity);
593 CAPTURE(el.expected);
594 CAPTURE(actual);
595 CHECK(std::abs(actual / el.expected - 1) < el.tol);
596 }
597}
598
599}; /* namespace TransportValidation */
600
601static CoolProp::input_pairs inputs[] = {
603 //CoolProp::SmolarT_INPUTS,
604 //CoolProp::HmolarT_INPUTS,
605 //CoolProp::TUmolar_INPUTS,
606
607 // CoolProp::DmolarP_INPUTS,
608 // CoolProp::DmolarHmolar_INPUTS,
609 // CoolProp::DmolarSmolar_INPUTS,
610 // CoolProp::DmolarUmolar_INPUTS,
611 //
612 // CoolProp::HmolarP_INPUTS,
613 // CoolProp::PSmolar_INPUTS,
614 // CoolProp::PUmolar_INPUTS,
615 //
616 /*
617 CoolProp::HmolarSmolar_INPUTS,
618 CoolProp::HmolarUmolar_INPUTS,
619 CoolProp::SmolarUmolar_INPUTS
620 */
621};
622
623class ConsistencyFixture
624{
625 protected:
626 CoolPropDbl hmolar, pmolar, smolar, umolar, rhomolar, T, p, x1, x2;
627 shared_ptr<CoolProp::AbstractState> pState;
629
630 public:
631 ConsistencyFixture() {}
632 ~ConsistencyFixture() {}
633 void set_backend(std::string backend, std::string fluid_name) {
634 pState.reset(CoolProp::AbstractState::factory(backend, fluid_name));
635 }
636 void set_pair(CoolProp::input_pairs pair) {
637 this->pair = pair;
638 }
639 void set_TP(CoolPropDbl T, CoolPropDbl p) {
640 this->T = T;
641 this->p = p;
642 CoolProp::AbstractState& State = *pState;
643
644 // Start with T,P as inputs, cycle through all the other pairs that are supported
645 State.update(CoolProp::PT_INPUTS, p, T);
646
647 // Set the other state variables
648 rhomolar = State.rhomolar();
649 hmolar = State.hmolar();
650 smolar = State.smolar();
651 umolar = State.umolar();
652 }
653 void get_variables() {
654
655 switch (pair) {
658 x1 = hmolar;
659 x2 = T;
660 break;
662 x1 = smolar;
663 x2 = T;
664 break;
666 x1 = T;
667 x2 = umolar;
668 break;
670 x1 = rhomolar;
671 x2 = T;
672 break;
673
676 x1 = rhomolar;
677 x2 = hmolar;
678 break;
680 x1 = rhomolar;
681 x2 = smolar;
682 break;
684 x1 = rhomolar;
685 x2 = umolar;
686 break;
688 x1 = rhomolar;
689 x2 = p;
690 break;
691
694 x1 = hmolar;
695 x2 = p;
696 break;
698 x1 = p;
699 x2 = smolar;
700 break;
702 x1 = p;
703 x2 = umolar;
704 break;
705
707 x1 = hmolar;
708 x2 = smolar;
709 break;
711 x1 = smolar;
712 x2 = umolar;
713 break;
714
715 default:
716 throw CoolProp::ValueError();
717 }
718 }
719 void single_phase_consistency_check() {
720 CoolProp::AbstractState& State = *pState;
721 State.update(pair, x1, x2);
722
723 // Make sure we end up back at the same temperature and pressure we started out with
724 if (State.Q() < 1 && State.Q() > 0) throw CoolProp::ValueError(format("Q [%g] is between 0 and 1; two-phase solution", State.Q()));
725 if (std::abs(T - State.T()) > 1e-2) throw CoolProp::ValueError(format("Error on T [%Lg K] is greater than 1e-2", std::abs(State.T() - T)));
726 if (std::abs(p - State.p()) / p * 100 > 1e-2)
727 throw CoolProp::ValueError(format("Error on p [%Lg %%] is greater than 1e-2 %%", std::abs(p - State.p()) / p * 100));
728 }
729 void subcritical_pressure_liquid() {
730 // Subcritical pressure liquid
731 int inputsN = sizeof(inputs) / sizeof(inputs[0]);
732 for (double p = pState->p_triple() * 1.1; p < pState->p_critical(); p *= 3) {
733 double Ts = PropsSI("T", "P", p, "Q", 0, "Water");
734 double Tmelt = pState->melting_line(CoolProp::iT, CoolProp::iP, p);
735 for (double T = Tmelt; T < Ts - 0.1; T += 0.1) {
736 CHECK_NOTHROW(set_TP(T, p));
737
738 for (int i = 0; i < inputsN; ++i) {
739 CoolProp::input_pairs pair = inputs[i];
740 std::string pair_desc = CoolProp::get_input_pair_short_desc(pair);
741 set_pair(pair);
742 CAPTURE(pair_desc);
743 CAPTURE(T);
744 CAPTURE(p);
745 get_variables();
746 CAPTURE(x1);
747 CAPTURE(x2);
748 CAPTURE(Ts);
749 CHECK_NOTHROW(single_phase_consistency_check());
750 double rhomolar_RP = PropsSI("Dmolar", "P", p, "T", T, "REFPROP::Water");
751 if (ValidNumber(rhomolar_RP)) {
752 CAPTURE(rhomolar_RP);
753 CAPTURE(rhomolar);
754 CHECK(std::abs((rhomolar_RP - rhomolar) / rhomolar) < 1e-3);
755 }
756 }
757 }
758 }
759 }
760};
761
762TEST_CASE_METHOD(ConsistencyFixture, "Test all input pairs for Water using all valid backends", "[consistency]") {
763 CHECK_NOTHROW(set_backend("HEOS", "Water"));
764 subcritical_pressure_liquid();
765
766 // int inputsN = sizeof(inputs)/sizeof(inputs[0]);
767 // for (double p = 600000; p < pState->pmax(); p *= 3)
768 // {
769 // for (double T = 220; T < pState->Tmax(); T += 1)
770 // {
771 // CHECK_NOTHROW(set_TP(T, p));
772 //
773 // for (int i = 0; i < inputsN; ++i)
774 // {
775 // CoolProp::input_pairs pair = inputs[i];
776 // std::string pair_desc = CoolProp::get_input_pair_short_desc(pair);
777 // set_pair(pair);
778 // CAPTURE(pair_desc);
779 // CAPTURE(T);
780 // CAPTURE(p);
781 // get_variables();
782 // CAPTURE(x1);
783 // CAPTURE(x2);
784 // CHECK_NOTHROW(single_phase_consistency_check());
785 // }
786 // }
787 // }
788}
789
790TEST_CASE("Test saturation properties for a few fluids", "[saturation],[slow]") {
791 SECTION("sat_p") {
792 std::vector<double> pv = linspace(Props1SI("CO2", "ptriple"), Props1SI("CO2", "pcrit") - 1e-6, 5);
793
794 SECTION("All pressures are ok")
795 for (std::size_t i = 0; i < pv.size(); ++i) {
796 CAPTURE(pv[i]);
797 double T = CoolProp::PropsSI("T", "P", pv[i], "Q", 0, "CO2");
798 }
799 }
800}
801
802class HumidAirDewpointFixture
803{
804 public:
805 shared_ptr<CoolProp::AbstractState> AS;
806 std::vector<std::string> fluids;
807 std::vector<double> z;
808 void setup(double zH2O) {
809 double z_Air[4] = {0.7810, 0.2095, 0.0092, 0.0003}; // N2, O2, Ar, CO2
810 z.resize(5);
811 z[0] = zH2O;
812 for (int i = 0; i < 4; ++i) {
813 z[i + 1] = (1 - zH2O) * z_Air[i];
814 }
815 }
816 void run_p(double p) {
817 CAPTURE(p);
818 for (double zH2O = 0.999; zH2O > 0; zH2O -= 0.001) {
819 setup(zH2O);
820 AS->set_mole_fractions(z);
821 CAPTURE(zH2O);
822 CHECK_NOTHROW(AS->update(PQ_INPUTS, p, 1));
823 if (AS->T() < 273.15) {
824 break;
825 }
826 }
827 }
828 void run_checks() {
829 fluids = strsplit("Water&Nitrogen&Oxygen&Argon&CO2", '&');
830 AS.reset(AbstractState::factory("HEOS", fluids));
831 run_p(1e5);
832 run_p(1e6);
833 run_p(1e7);
834 }
835};
836//TEST_CASE_METHOD(HumidAirDewpointFixture, "Humid air dewpoint calculations", "[humid_air_dewpoint]") {
837// run_checks();
838//}
839
840TEST_CASE("Test consistency between Gernert models in CoolProp and Gernert models in REFPROP", "[Gernert]") {
841 // See https://groups.google.com/forum/?fromgroups#!topic/catch-forum/mRBKqtTrITU
842 std::string mixes[] = {"CO2[0.7]&Argon[0.3]", "CO2[0.7]&Water[0.3]", "CO2[0.7]&Nitrogen[0.3]"};
843 for (int i = 0; i < 3; ++i) {
844 const char* ykey = mixes[i].c_str();
845 std::ostringstream ss1;
846 ss1 << mixes[i];
847 SECTION(ss1.str(), "") {
848 double Tnbp_CP, Tnbp_RP, R_RP, R_CP, pchk_CP, pchk_RP;
849 CHECK_NOTHROW(R_CP = PropsSI("gas_constant", "P", 101325, "Q", 1, "HEOS::" + mixes[i]));
850 CAPTURE(R_CP);
851 CHECK_NOTHROW(R_RP = PropsSI("gas_constant", "P", 101325, "Q", 1, "REFPROP::" + mixes[i]));
852 CAPTURE(R_RP);
853 CHECK_NOTHROW(Tnbp_CP = PropsSI("T", "P", 101325, "Q", 1, "HEOS::" + mixes[i]));
854 CAPTURE(Tnbp_CP);
855 CHECK_NOTHROW(pchk_CP = PropsSI("P", "T", Tnbp_CP, "Q", 1, "HEOS::" + mixes[i]));
856 CAPTURE(pchk_CP);
857 CHECK_NOTHROW(Tnbp_RP = PropsSI("T", "P", 101325, "Q", 1, "REFPROP::" + mixes[i]));
858 CAPTURE(Tnbp_RP);
859 CHECK_NOTHROW(pchk_RP = PropsSI("P", "T", Tnbp_RP, "Q", 1, "REFPROP::" + mixes[i]));
860 CAPTURE(pchk_RP);
861 double diff = std::abs(Tnbp_CP / Tnbp_RP - 1);
862 CHECK(diff < 1e-2);
863 }
864 }
865}
866
867TEST_CASE("Tests for solvers in P,T flash using Water", "[flash],[PT]") {
868 SECTION("Check that T,P for saturated state yields error") {
869 double Ts, ps, rho;
870 CHECK_NOTHROW(Ts = PropsSI("T", "P", 101325, "Q", 0, "Water"));
871 CHECK(ValidNumber(Ts));
872 CHECK_NOTHROW(ps = PropsSI("P", "T", Ts, "Q", 0, "Water"));
873 CHECK(ValidNumber(ps));
874 CAPTURE(Ts);
875 CAPTURE(ps);
876 CHECK_NOTHROW(rho = PropsSI("D", "T", Ts, "P", ps, "Water"));
877 CAPTURE(rho);
878 CHECK(!ValidNumber(rho));
879 }
880 SECTION("Subcritical p slightly subcooled should be ok") {
881 double Ts, rho, dT = 1e-4;
882 CHECK_NOTHROW(Ts = PropsSI("T", "P", 101325, "Q", 0, "Water"));
883 CAPTURE(Ts);
884 CHECK(ValidNumber(Ts));
885 CAPTURE(dT);
886 CHECK_NOTHROW(rho = PropsSI("D", "T", Ts - dT, "P", 101325, "Water"));
887 CAPTURE(rho);
888 CHECK(ValidNumber(rho));
889 }
890 SECTION("Subcritical p slightly superheated should be ok") {
891 double Ts, rho, dT = 1e-4;
892 CHECK_NOTHROW(Ts = PropsSI("T", "P", 101325, "Q", 0, "Water"));
893 CAPTURE(Ts);
894 CHECK(ValidNumber(Ts));
895 CAPTURE(dT);
896 CHECK_NOTHROW(rho = PropsSI("D", "T", Ts + dT, "P", 101325, "Water"));
897 CAPTURE(rho);
898 CHECK(ValidNumber(rho));
899 }
900}
901
902TEST_CASE("Tests for solvers in P,Y flash using Water", "[flash],[PH],[PS],[PU]") {
903 double Ts, y, T2;
904 // See https://groups.google.com/forum/?fromgroups#!topic/catch-forum/mRBKqtTrITU
905 std::string Ykeys[] = {"H", "S", "U", "Hmass", "Smass", "Umass", "Hmolar", "Smolar", "Umolar"};
906 for (int i = 0; i < 9; ++i) {
907 const char* ykey = Ykeys[i].c_str();
908 std::ostringstream ss1;
909 ss1 << "Subcritical superheated P," << ykey;
910 SECTION(ss1.str(), "") {
911 double dT = 10;
912 CHECK_NOTHROW(Ts = PropsSI("T", "P", 101325, "Q", 0, "Water"));
913 CHECK(ValidNumber(Ts));
914 CAPTURE(Ts);
915 CHECK_NOTHROW(y = PropsSI(ykey, "T", Ts + dT, "P", 101325, "Water"));
916 CAPTURE(dT);
917 CAPTURE(y);
918 CHECK(ValidNumber(y));
919 CHECK_NOTHROW(T2 = PropsSI("T", ykey, y, "P", 101325, "Water"));
920 CAPTURE(CoolProp::get_global_param_string("errstring"));
921 CAPTURE(T2);
922 CHECK(ValidNumber(T2));
923 }
924 std::ostringstream ss2;
925 ss2 << "Subcritical barely superheated P," << ykey;
926 SECTION(ss2.str(), "") {
927 double dT = 1e-3;
928 CHECK_NOTHROW(Ts = PropsSI("T", "P", 101325, "Q", 0, "Water"));
929 CHECK(ValidNumber(Ts));
930 CAPTURE(Ts);
931 CHECK_NOTHROW(y = PropsSI(ykey, "T", Ts + dT, "P", 101325, "Water"));
932 CAPTURE(dT);
933 CAPTURE(y);
934 CHECK(ValidNumber(y));
935 CHECK_NOTHROW(T2 = PropsSI("T", ykey, y, "P", 101325, "Water"));
936 CAPTURE(CoolProp::get_global_param_string("errstring"));
937 CAPTURE(T2);
938 CHECK(ValidNumber(T2));
939 }
940 std::ostringstream ss3;
941 ss3 << "Subcritical subcooled P," << ykey;
942 SECTION(ss3.str(), "") {
943 double dT = -10;
944 CHECK_NOTHROW(Ts = PropsSI("T", "P", 101325, "Q", 0, "Water"));
945 CHECK(ValidNumber(Ts));
946 CAPTURE(Ts);
947 CHECK_NOTHROW(y = PropsSI(ykey, "T", Ts + dT, "P", 101325, "Water"));
948 CAPTURE(dT);
949 CAPTURE(y);
950 CHECK(ValidNumber(y));
951 CHECK_NOTHROW(T2 = PropsSI("T", ykey, y, "P", 101325, "Water"));
952 CAPTURE(CoolProp::get_global_param_string("errstring"));
953 CAPTURE(T2);
954 CHECK(ValidNumber(T2));
955 }
956 std::ostringstream ss4;
957 ss4 << "Subcritical barely subcooled P," << ykey;
958 SECTION(ss4.str(), "") {
959 double dT = -1e-3;
960 CHECK_NOTHROW(Ts = PropsSI("T", "P", 101325, "Q", 0, "Water"));
961 CHECK(ValidNumber(Ts));
962 CAPTURE(Ts);
963 CHECK_NOTHROW(y = PropsSI(ykey, "T", Ts + dT, "P", 101325, "Water"));
964 CAPTURE(dT);
965 CAPTURE(y);
966 CHECK(ValidNumber(y));
967 CHECK_NOTHROW(T2 = PropsSI("T", ykey, y, "P", 101325, "Water"));
968 CAPTURE(CoolProp::get_global_param_string("errstring"));
969 CAPTURE(T2);
970 CHECK(ValidNumber(T2));
971 }
972 std::ostringstream ss5;
973 ss5 << "Supercritical P," << ykey;
974 SECTION(ss5.str(), "") {
975 double Tc = Props1SI("Water", "Tcrit");
976 double pc = Props1SI("Water", "pcrit");
977 double p = pc * 1.3;
978 double T = Tc * 1.3;
979 CAPTURE(T);
980 CAPTURE(p);
981 CHECK(ValidNumber(T));
982 CHECK(ValidNumber(p));
983 CHECK_NOTHROW(y = PropsSI(ykey, "P", p, "T", T, "Water"));
984 CAPTURE(y);
985 CHECK(ValidNumber(y));
986 CHECK_NOTHROW(T2 = PropsSI("T", ykey, y, "P", p, "Water"));
987 CAPTURE(CoolProp::get_global_param_string("errstring"));
988 CAPTURE(T2);
989 CHECK(ValidNumber(T2));
990 }
991 std::ostringstream ss6;
992 ss6 << "Supercritical \"gas\" P," << ykey;
993 SECTION(ss6.str(), "") {
994 double Tc = Props1SI("Water", "Tcrit");
995 double pc = Props1SI("Water", "pcrit");
996 double p = pc * 0.7;
997 double T = Tc * 1.3;
998 CAPTURE(T);
999 CAPTURE(p);
1000 CHECK(ValidNumber(T));
1001 CHECK(ValidNumber(p));
1002 CHECK_NOTHROW(y = PropsSI(ykey, "P", p, "T", T, "Water"));
1003 CAPTURE(y);
1004 CHECK(ValidNumber(y));
1005 CHECK_NOTHROW(T2 = PropsSI("T", ykey, y, "P", p, "Water"));
1006 CAPTURE(CoolProp::get_global_param_string("errstring"));
1007 CAPTURE(T2);
1008 CHECK(ValidNumber(T2));
1009 }
1010 std::ostringstream ss7;
1011 ss7 << "Supercritical \"liquid\" P," << ykey;
1012 SECTION(ss7.str(), "") {
1013 double Tc = Props1SI("Water", "Tcrit");
1014 double pc = Props1SI("Water", "pcrit");
1015 double p = pc * 2;
1016 double T = Tc * 0.5;
1017 CAPTURE(T);
1018 CAPTURE(p);
1019 CHECK(ValidNumber(T));
1020 CHECK(ValidNumber(p));
1021 CHECK_NOTHROW(y = PropsSI(ykey, "P", p, "T", T, "Water"));
1022 CAPTURE(y);
1023 CHECK(ValidNumber(y));
1024 CHECK_NOTHROW(T2 = PropsSI("T", ykey, y, "P", p, "Water"));
1025 CAPTURE(CoolProp::get_global_param_string("errstring"));
1026 CAPTURE(T2);
1027 CHECK(ValidNumber(T2));
1028 }
1029 }
1030}
1031
1032TEST_CASE("R134A saturation bug in dev", "[2545]"){
1033 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "R134A"));
1034 AS->update(QT_INPUTS, 1, 273);
1035 double p = AS->p();
1036 CHECK(p == Catch::Approx(291215));
1037}
1038
1039TEST_CASE("Tests for solvers in P,H flash using Propane", "[flashdups],[flash],[PH],[consistency]") {
1040 double hmolar, hmass;
1041 SECTION("5 times PH with HEOS AbstractState yields same results every time", "") {
1042 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "n-Propane"));
1043
1044 CHECK_NOTHROW(AS->update(CoolProp::PT_INPUTS, 101325, 300));
1045 hmolar = AS->hmolar();
1046 hmass = AS->hmass();
1047 CHECK_NOTHROW(AS->update(CoolProp::HmassP_INPUTS, hmass, 101325));
1048 CHECK_NOTHROW(AS->update(CoolProp::HmolarP_INPUTS, hmolar, 101325));
1049 hmolar = AS->hmolar();
1050 hmass = AS->hmass();
1051 CHECK_NOTHROW(AS->update(CoolProp::HmassP_INPUTS, hmass, 101325));
1052 CHECK_NOTHROW(AS->update(CoolProp::HmolarP_INPUTS, hmolar, 101325));
1053 hmolar = AS->hmolar();
1054 hmass = AS->hmass();
1055 CHECK_NOTHROW(AS->update(CoolProp::HmassP_INPUTS, hmass, 101325));
1056 CHECK_NOTHROW(AS->update(CoolProp::HmolarP_INPUTS, hmolar, 101325));
1057 hmolar = AS->hmolar();
1058 hmass = AS->hmass();
1059 CHECK_NOTHROW(AS->update(CoolProp::HmassP_INPUTS, hmass, 101325));
1060 CHECK_NOTHROW(AS->update(CoolProp::HmolarP_INPUTS, hmolar, 101325));
1061 hmolar = AS->hmolar();
1062 hmass = AS->hmass();
1063 CHECK_NOTHROW(AS->update(CoolProp::HmassP_INPUTS, hmass, 101325));
1064 CHECK_NOTHROW(AS->update(CoolProp::HmolarP_INPUTS, hmolar, 101325));
1065 }
1066}
1067
1068TEST_CASE("Multiple calls to state class are consistent", "[flashdups],[flash],[PH],[consistency]") {
1069 double hmolar, hmass;
1070 SECTION("3 times PH with HEOS AbstractState yields same results every time", "") {
1071 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "n-Propane"));
1072
1073 CHECK_NOTHROW(AS->update(CoolProp::PT_INPUTS, 101325, 300));
1074 hmolar = AS->hmolar();
1075 hmass = AS->hmass();
1076 CHECK_NOTHROW(AS->update(CoolProp::HmassP_INPUTS, hmass, 101325));
1077 CHECK_NOTHROW(AS->update(CoolProp::HmolarP_INPUTS, hmolar, 101325));
1078 hmolar = AS->hmolar();
1079 hmass = AS->hmass();
1080 CHECK_NOTHROW(AS->update(CoolProp::HmassP_INPUTS, hmass, 101325));
1081 CHECK_NOTHROW(AS->update(CoolProp::HmolarP_INPUTS, hmolar, 101325));
1082 hmolar = AS->hmolar();
1083 hmass = AS->hmass();
1084 CHECK_NOTHROW(AS->update(CoolProp::HmassP_INPUTS, hmass, 101325));
1085 CHECK_NOTHROW(AS->update(CoolProp::HmolarP_INPUTS, hmolar, 101325));
1086 }
1087}
1088
1089TEST_CASE("Test first partial derivatives using PropsSI", "[derivatives]") {
1090 double T = 300;
1091 SECTION("Check drhodp|T 3 ways", "") {
1092 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "n-Propane"));
1093 AS->update(CoolProp::PT_INPUTS, 101325, T);
1094
1095 double drhomolardp__T_AbstractState = AS->first_partial_deriv(CoolProp::iDmolar, CoolProp::iP, CoolProp::iT);
1096 double drhomolardp__T_PropsSI_num =
1097 (PropsSI("Dmolar", "T", T, "P", 101325 + 1e-3, "n-Propane") - PropsSI("Dmolar", "T", T, "P", 101325 - 1e-3, "n-Propane")) / (2 * 1e-3);
1098 double drhomolardp__T_PropsSI = PropsSI("d(Dmolar)/d(P)|T", "T", T, "P", 101325, "n-Propane");
1099
1100 CAPTURE(drhomolardp__T_AbstractState);
1101 CAPTURE(drhomolardp__T_PropsSI_num);
1102 CAPTURE(drhomolardp__T_PropsSI);
1103 double rel_err_exact = std::abs((drhomolardp__T_AbstractState - drhomolardp__T_PropsSI) / drhomolardp__T_PropsSI);
1104 double rel_err_approx = std::abs((drhomolardp__T_PropsSI_num - drhomolardp__T_PropsSI) / drhomolardp__T_PropsSI);
1105 CHECK(rel_err_exact < 1e-7);
1106 CHECK(rel_err_approx < 1e-7);
1107 }
1108 SECTION("Check drhodp|T 3 ways for water", "") {
1109 T = 80 + 273.15;
1110 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "Water"));
1111 AS->update(CoolProp::PT_INPUTS, 101325, T);
1112
1113 double drhomolardp__T_AbstractState = AS->first_partial_deriv(CoolProp::iDmolar, CoolProp::iP, CoolProp::iT);
1114 double drhomolardp__T_PropsSI_num =
1115 (PropsSI("Dmolar", "T", T, "P", 101325 + 1, "Water") - PropsSI("Dmolar", "T", T, "P", 101325 - 1, "Water")) / (2 * 1);
1116 double drhomolardp__T_PropsSI = PropsSI("d(Dmolar)/d(P)|T", "T", T, "P", 101325, "Water");
1117
1118 CAPTURE(drhomolardp__T_AbstractState);
1119 CAPTURE(drhomolardp__T_PropsSI_num);
1120 CAPTURE(drhomolardp__T_PropsSI);
1121 double rel_err_exact = std::abs((drhomolardp__T_AbstractState - drhomolardp__T_PropsSI) / drhomolardp__T_PropsSI);
1122 double rel_err_approx = std::abs((drhomolardp__T_PropsSI_num - drhomolardp__T_PropsSI) / drhomolardp__T_PropsSI);
1123 CHECK(rel_err_exact < 1e-4);
1124 CHECK(rel_err_approx < 1e-4);
1125 }
1126 SECTION("Check dpdrho|T 3 ways for water", "") {
1127 T = 80 + 273.15;
1128 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "Water"));
1129 AS->update(CoolProp::PT_INPUTS, 101325, T);
1130 CoolPropDbl rhomolar = AS->rhomolar();
1131 double dpdrhomolar__T_AbstractState = AS->first_partial_deriv(CoolProp::iP, CoolProp::iDmolar, CoolProp::iT);
1132 double dpdrhomolar__T_PropsSI_num =
1133 (PropsSI("P", "T", T, "Dmolar", rhomolar + 1e-3, "Water") - PropsSI("P", "T", T, "Dmolar", rhomolar - 1e-3, "Water")) / (2 * 1e-3);
1134 double dpdrhomolar__T_PropsSI = PropsSI("d(P)/d(Dmolar)|T", "T", T, "P", 101325, "Water");
1135 CAPTURE(rhomolar);
1136 CAPTURE(dpdrhomolar__T_AbstractState);
1137 CAPTURE(dpdrhomolar__T_PropsSI_num);
1138 CAPTURE(dpdrhomolar__T_PropsSI);
1139 double rel_err_exact = std::abs((dpdrhomolar__T_AbstractState - dpdrhomolar__T_PropsSI) / dpdrhomolar__T_PropsSI);
1140 double rel_err_approx = std::abs((dpdrhomolar__T_PropsSI_num - dpdrhomolar__T_PropsSI) / dpdrhomolar__T_PropsSI);
1141 CHECK(rel_err_exact < 1e-6);
1142 CHECK(rel_err_approx < 1e-6);
1143 }
1144 SECTION("Check dpdrho|T 3 ways for water using mass based", "") {
1145 T = 80 + 273.15;
1146 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "Water"));
1147 AS->update(CoolProp::PT_INPUTS, 101325, T);
1148 CoolPropDbl rhomass = AS->rhomass();
1149 double dpdrhomass__T_AbstractState = AS->first_partial_deriv(CoolProp::iP, CoolProp::iDmass, CoolProp::iT);
1150 double dpdrhomass__T_PropsSI_num =
1151 (PropsSI("P", "T", T, "Dmass", rhomass + 1e-3, "Water") - PropsSI("P", "T", T, "Dmass", rhomass - 1e-3, "Water")) / (2 * 1e-3);
1152 double dpdrhomass__T_PropsSI = PropsSI("d(P)/d(Dmass)|T", "T", T, "P", 101325, "Water");
1153 CAPTURE(rhomass);
1154 CAPTURE(dpdrhomass__T_AbstractState);
1155 CAPTURE(dpdrhomass__T_PropsSI_num);
1156 CAPTURE(dpdrhomass__T_PropsSI);
1157 double rel_err_exact = std::abs((dpdrhomass__T_AbstractState - dpdrhomass__T_PropsSI) / dpdrhomass__T_PropsSI);
1158 double rel_err_approx = std::abs((dpdrhomass__T_PropsSI_num - dpdrhomass__T_PropsSI) / dpdrhomass__T_PropsSI);
1159 CHECK(rel_err_exact < 1e-7);
1160 CHECK(rel_err_approx < 1e-7);
1161 }
1162 SECTION("Invalid first partial derivatives", "") {
1163 CHECK(!ValidNumber(PropsSI("d()/d(P)|T", "T", 300, "P", 101325, "n-Propane")));
1164 CHECK(!ValidNumber(PropsSI("d(Dmolar)/d()|T", "T", 300, "P", 101325, "n-Propane")));
1165 CHECK(!ValidNumber(PropsSI("d(Dmolar)/d(P)|", "T", 300, "P", 101325, "n-Propane")));
1166 CHECK(!ValidNumber(PropsSI("d(XXXX)/d(P)|T", "T", 300, "P", 101325, "n-Propane")));
1167 CHECK(!ValidNumber(PropsSI("d(Dmolar)d(P)|T", "T", 300, "P", 101325, "n-Propane")));
1168 CHECK(!ValidNumber(PropsSI("d(Dmolar)/d(P)T", "T", 300, "P", 101325, "n-Propane")));
1169 CHECK(!ValidNumber(PropsSI("d(Bvirial)/d(P)T", "T", 300, "P", 101325, "n-Propane")));
1170 CHECK(!ValidNumber(PropsSI("d(Tcrit)/d(P)T", "T", 300, "P", 101325, "n-Propane")));
1171 }
1172}
1173
1174TEST_CASE("Test second partial derivatives", "[derivatives]") {
1175 double T = 300;
1176 SECTION("Check d2pdrho2|T 3 ways", "") {
1177 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "Water"));
1178 double rhomolar = 60000;
1179 AS->update(CoolProp::DmolarT_INPUTS, rhomolar, T);
1180 double p = AS->p();
1181
1182 double d2pdrhomolar2__T_AbstractState =
1184 // Centered second derivative
1185 double del = 1e0;
1186 double d2pdrhomolar2__T_PropsSI_num =
1187 (PropsSI("P", "T", T, "Dmolar", rhomolar + del, "Water") - 2 * PropsSI("P", "T", T, "Dmolar", rhomolar, "Water")
1188 + PropsSI("P", "T", T, "Dmolar", rhomolar - del, "Water"))
1189 / pow(del, 2);
1190 double d2pdrhomolar2__T_PropsSI = PropsSI("d(d(P)/d(Dmolar)|T)/d(Dmolar)|T", "T", T, "Dmolar", rhomolar, "Water");
1191
1192 CAPTURE(d2pdrhomolar2__T_AbstractState);
1193 CAPTURE(d2pdrhomolar2__T_PropsSI_num);
1194 double rel_err_exact = std::abs((d2pdrhomolar2__T_AbstractState - d2pdrhomolar2__T_PropsSI) / d2pdrhomolar2__T_PropsSI);
1195 double rel_err_approx = std::abs((d2pdrhomolar2__T_PropsSI_num - d2pdrhomolar2__T_AbstractState) / d2pdrhomolar2__T_AbstractState);
1196 CHECK(rel_err_exact < 1e-5);
1197 CHECK(rel_err_approx < 1e-5);
1198 }
1199 SECTION("Valid second partial derivatives", "") {
1200 CHECK(ValidNumber(PropsSI("d(d(Hmolar)/d(P)|T)/d(T)|Dmolar", "T", 300, "P", 101325, "n-Propane")));
1201 }
1202 SECTION("Invalid second partial derivatives", "") {
1203 CHECK(!ValidNumber(PropsSI("d(d()/d(P)|T)/d()|", "T", 300, "P", 101325, "n-Propane")));
1204 CHECK(!ValidNumber(PropsSI("dd(Dmolar)/d()|T)|T", "T", 300, "P", 101325, "n-Propane")));
1205 }
1206 SECTION("Check derivatives with respect to T", "") {
1207 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "Propane"));
1208 double rhomolar = 100, dT = 1e-1;
1209 AS->update(CoolProp::DmolarT_INPUTS, rhomolar, T);
1210
1211 // base state
1212 CoolPropDbl T0 = AS->T(), rhomolar0 = AS->rhomolar(), hmolar0 = AS->hmolar(), smolar0 = AS->smolar(), umolar0 = AS->umolar(), p0 = AS->p();
1213 CoolPropDbl dhdT_rho_ana = AS->first_partial_deriv(CoolProp::iHmolar, CoolProp::iT, CoolProp::iDmolar);
1214 CoolPropDbl d2hdT2_rho_ana = AS->second_partial_deriv(CoolProp::iHmolar, CoolProp::iT, CoolProp::iDmolar, CoolProp::iT, CoolProp::iDmolar);
1215 CoolPropDbl dsdT_rho_ana = AS->first_partial_deriv(CoolProp::iSmolar, CoolProp::iT, CoolProp::iDmolar);
1216 CoolPropDbl d2sdT2_rho_ana = AS->second_partial_deriv(CoolProp::iSmolar, CoolProp::iT, CoolProp::iDmolar, CoolProp::iT, CoolProp::iDmolar);
1217 CoolPropDbl dudT_rho_ana = AS->first_partial_deriv(CoolProp::iUmolar, CoolProp::iT, CoolProp::iDmolar);
1218 CoolPropDbl d2udT2_rho_ana = AS->second_partial_deriv(CoolProp::iUmolar, CoolProp::iT, CoolProp::iDmolar, CoolProp::iT, CoolProp::iDmolar);
1219 CoolPropDbl dpdT_rho_ana = AS->first_partial_deriv(CoolProp::iP, CoolProp::iT, CoolProp::iDmolar);
1220 CoolPropDbl d2pdT2_rho_ana = AS->second_partial_deriv(CoolProp::iP, CoolProp::iT, CoolProp::iDmolar, CoolProp::iT, CoolProp::iDmolar);
1221
1222 // increment T
1223 AS->update(CoolProp::DmolarT_INPUTS, rhomolar, T + dT);
1224 CoolPropDbl Tpt = AS->T(), rhomolarpt = AS->rhomolar(), hmolarpt = AS->hmolar(), smolarpt = AS->smolar(), umolarpt = AS->umolar(),
1225 ppt = AS->p();
1226 // decrement T
1227 AS->update(CoolProp::DmolarT_INPUTS, rhomolar, T - dT);
1228 CoolPropDbl Tmt = AS->T(), rhomolarmt = AS->rhomolar(), hmolarmt = AS->hmolar(), smolarmt = AS->smolar(), umolarmt = AS->umolar(),
1229 pmt = AS->p();
1230
1231 CoolPropDbl dhdT_rho_num = (hmolarpt - hmolarmt) / (2 * dT);
1232 CoolPropDbl d2hdT2_rho_num = (hmolarpt - 2 * hmolar0 + hmolarmt) / pow(dT, 2);
1233 CoolPropDbl dsdT_rho_num = (smolarpt - smolarmt) / (2 * dT);
1234 CoolPropDbl d2sdT2_rho_num = (smolarpt - 2 * smolar0 + smolarmt) / pow(dT, 2);
1235 CoolPropDbl dudT_rho_num = (umolarpt - umolarmt) / (2 * dT);
1236 CoolPropDbl d2udT2_rho_num = (umolarpt - 2 * umolar0 + umolarmt) / pow(dT, 2);
1237 CoolPropDbl dpdT_rho_num = (ppt - pmt) / (2 * dT);
1238 CoolPropDbl d2pdT2_rho_num = (ppt - 2 * p0 + pmt) / pow(dT, 2);
1239
1240 CAPTURE(format("%0.15Lg", d2pdT2_rho_ana).c_str());
1241
1242 double tol = 1e-4;
1243 CHECK(std::abs((dhdT_rho_num - dhdT_rho_ana) / dhdT_rho_ana) < tol);
1244 CHECK(std::abs((d2hdT2_rho_num - d2hdT2_rho_ana) / d2hdT2_rho_ana) < tol);
1245 CHECK(std::abs((dpdT_rho_num - dpdT_rho_ana) / dpdT_rho_ana) < tol);
1246 CHECK(std::abs((d2pdT2_rho_num - d2pdT2_rho_ana) / d2pdT2_rho_ana) < tol);
1247 CHECK(std::abs((dsdT_rho_num - dsdT_rho_ana) / dsdT_rho_ana) < tol);
1248 CHECK(std::abs((d2sdT2_rho_num - d2sdT2_rho_ana) / d2sdT2_rho_ana) < tol);
1249 CHECK(std::abs((dudT_rho_num - dudT_rho_ana) / dudT_rho_ana) < tol);
1250 CHECK(std::abs((d2udT2_rho_num - d2udT2_rho_ana) / d2udT2_rho_ana) < tol);
1251 }
1252
1253 SECTION("Check derivatives with respect to rho", "") {
1254 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "Propane"));
1255 double rhomolar = 100, drho = 1e-1;
1256 AS->update(CoolProp::DmolarT_INPUTS, rhomolar, T);
1257
1258 // base state
1259 CoolPropDbl T0 = AS->T(), rhomolar0 = AS->rhomolar(), hmolar0 = AS->hmolar(), smolar0 = AS->smolar(), umolar0 = AS->umolar(), p0 = AS->p();
1260 CoolPropDbl dhdrho_T_ana = AS->first_partial_deriv(CoolProp::iHmolar, CoolProp::iDmolar, CoolProp::iT);
1261 CoolPropDbl d2hdrho2_T_ana = AS->second_partial_deriv(CoolProp::iHmolar, CoolProp::iDmolar, CoolProp::iT, CoolProp::iDmolar, CoolProp::iT);
1262 CoolPropDbl dsdrho_T_ana = AS->first_partial_deriv(CoolProp::iSmolar, CoolProp::iDmolar, CoolProp::iT);
1263 CoolPropDbl d2sdrho2_T_ana = AS->second_partial_deriv(CoolProp::iSmolar, CoolProp::iDmolar, CoolProp::iT, CoolProp::iDmolar, CoolProp::iT);
1264 CoolPropDbl dudrho_T_ana = AS->first_partial_deriv(CoolProp::iUmolar, CoolProp::iDmolar, CoolProp::iT);
1265 CoolPropDbl d2udrho2_T_ana = AS->second_partial_deriv(CoolProp::iUmolar, CoolProp::iDmolar, CoolProp::iT, CoolProp::iDmolar, CoolProp::iT);
1266 CoolPropDbl dpdrho_T_ana = AS->first_partial_deriv(CoolProp::iP, CoolProp::iDmolar, CoolProp::iT);
1267 CoolPropDbl d2pdrho2_T_ana = AS->second_partial_deriv(CoolProp::iP, CoolProp::iDmolar, CoolProp::iT, CoolProp::iDmolar, CoolProp::iT);
1268
1269 // increment rho
1270 AS->update(CoolProp::DmolarT_INPUTS, rhomolar + drho, T);
1271 CoolPropDbl Tpr = AS->T(), rhomolarpr = AS->rhomolar(), hmolarpr = AS->hmolar(), smolarpr = AS->smolar(), umolarpr = AS->umolar(),
1272 ppr = AS->p();
1273 // decrement rho
1274 AS->update(CoolProp::DmolarT_INPUTS, rhomolar - drho, T);
1275 CoolPropDbl Tmr = AS->T(), rhomolarmr = AS->rhomolar(), hmolarmr = AS->hmolar(), smolarmr = AS->smolar(), umolarmr = AS->umolar(),
1276 pmr = AS->p();
1277
1278 CoolPropDbl dhdrho_T_num = (hmolarpr - hmolarmr) / (2 * drho);
1279 CoolPropDbl d2hdrho2_T_num = (hmolarpr - 2 * hmolar0 + hmolarmr) / pow(drho, 2);
1280 CoolPropDbl dsdrho_T_num = (smolarpr - smolarmr) / (2 * drho);
1281 CoolPropDbl d2sdrho2_T_num = (smolarpr - 2 * smolar0 + smolarmr) / pow(drho, 2);
1282 CoolPropDbl dudrho_T_num = (umolarpr - umolarmr) / (2 * drho);
1283 CoolPropDbl d2udrho2_T_num = (umolarpr - 2 * umolar0 + umolarmr) / pow(drho, 2);
1284 CoolPropDbl dpdrho_T_num = (ppr - pmr) / (2 * drho);
1285 CoolPropDbl d2pdrho2_T_num = (ppr - 2 * p0 + pmr) / pow(drho, 2);
1286
1287 CAPTURE(format("%0.15Lg", d2pdrho2_T_ana).c_str());
1288
1289 double tol = 1e-4;
1290 CHECK(std::abs((dhdrho_T_num - dhdrho_T_ana) / dhdrho_T_ana) < tol);
1291 CHECK(std::abs((d2hdrho2_T_num - d2hdrho2_T_ana) / d2hdrho2_T_ana) < tol);
1292 CHECK(std::abs((dpdrho_T_num - dpdrho_T_ana) / dpdrho_T_ana) < tol);
1293 CHECK(std::abs((d2pdrho2_T_num - d2pdrho2_T_ana) / d2pdrho2_T_ana) < tol);
1294 CHECK(std::abs((dsdrho_T_num - dsdrho_T_ana) / dsdrho_T_ana) < tol);
1295 CHECK(std::abs((d2sdrho2_T_num - d2sdrho2_T_ana) / d2sdrho2_T_ana) < tol);
1296 CHECK(std::abs((dudrho_T_num - dudrho_T_ana) / dudrho_T_ana) < tol);
1297 CHECK(std::abs((d2udrho2_T_num - d2udrho2_T_ana) / d2udrho2_T_ana) < tol);
1298 }
1299 SECTION("Check second mixed partial(h,p) with respect to rho", "") {
1300 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "Propane"));
1301 double dhmass = 1.0, T = 300;
1302 AS->update(CoolProp::QT_INPUTS, 0.0, T);
1303 double deriv1 = AS->first_partial_deriv(iDmass, iP, iHmass);
1304 double deriv_analyt = AS->second_partial_deriv(iDmass, iP, iHmass, iHmass, iP);
1305 double deriv_analyt2 = AS->second_partial_deriv(iDmass, iHmass, iP, iP, iHmass);
1306 AS->update(CoolProp::HmassP_INPUTS, AS->hmass() - 1, AS->p());
1307 double deriv2 = AS->first_partial_deriv(iDmass, iP, iHmass);
1308 double deriv_num = (deriv1 - deriv2) / dhmass;
1309 CAPTURE(deriv_num);
1310 CAPTURE(deriv_analyt);
1311
1312 double tol = 1e-4;
1313 CHECK(std::abs((deriv_num - deriv_analyt) / deriv_analyt) < tol);
1314 }
1315}
1316
1317TEST_CASE("REFPROP names for coolprop fluids", "[REFPROPName]") {
1318 std::vector<std::string> fluids = strsplit(CoolProp::get_global_param_string("fluids_list"), ',');
1319 for (std::size_t i = 0; i < fluids.size(); ++i) {
1320 std::ostringstream ss1;
1321 ss1 << "Check that REFPROP fluid name for fluid " << fluids[i] << " is valid";
1322 SECTION(ss1.str(), "") {
1323 std::string RPName = get_fluid_param_string(fluids[i], "REFPROPName");
1324 CHECK(!RPName.empty());
1325 CAPTURE(RPName);
1326 if (!RPName.compare("N/A")) {
1327 break;
1328 }
1329 CHECK(ValidNumber(Props1SI("REFPROP::" + RPName, "molemass")));
1330 CHECK(ValidNumber(Props1SI(RPName, "molemass")));
1331 }
1332 }
1333}
1334TEST_CASE("Backwards compatibility for REFPROP v4 fluid name convention", "[REFPROP_backwards_compatibility]") {
1335 SECTION("REFPROP-", "") {
1336 double val = Props1SI("REFPROP-Water", "Tcrit");
1337 std::string err = get_global_param_string("errstring");
1338 CAPTURE(val);
1339 CAPTURE(err);
1340 CHECK(ValidNumber(val));
1341 }
1342 SECTION("REFPROP-MIX:", "") {
1343 double val = PropsSI("T", "P", 101325, "Q", 0, "REFPROP-MIX:Methane[0.5]&Ethane[0.5]");
1344 std::string err = get_global_param_string("errstring");
1345 CAPTURE(val);
1346 CAPTURE(err);
1347 CHECK(ValidNumber(val));
1348 }
1349}
1350
1351class AncillaryFixture
1352{
1353 public:
1354 std::string name;
1355 void run_checks() {
1356 std::vector<std::string> fluids = strsplit(CoolProp::get_global_param_string("fluids_list"), ',');
1357 for (std::size_t i = 0; i < fluids.size(); ++i) {
1358 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", fluids[i]));
1359 auto* rHEOS = dynamic_cast<HelmholtzEOSMixtureBackend*>(AS.get());
1360 if (!rHEOS->is_pure()){
1361 continue;
1362 }
1363 do_sat(AS);
1364 }
1365 }
1366 void do_sat(shared_ptr<CoolProp::AbstractState>& AS) {
1367 for (double f = 0.1; f < 1; f += 0.4) {
1368 double Tc = AS->T_critical();
1369 double Tt = AS->Ttriple();
1370 double T = f * Tc + (1 - f) * Tt;
1371 name = strjoin(AS->fluid_names(), "&");
1372
1373 AS->update(CoolProp::QT_INPUTS, 0, T);
1374 check_rhoL(AS);
1375 check_pL(AS);
1376
1377 AS->update(CoolProp::QT_INPUTS, 1, T);
1378 check_rhoV(AS);
1379 check_pV(AS);
1380 }
1381 }
1382 void check_pL(const shared_ptr<CoolProp::AbstractState>& AS) {
1383 double p_EOS = AS->saturated_liquid_keyed_output(iP);
1384 double p_anc = AS->saturation_ancillary(CoolProp::iP, 0, CoolProp::iT, AS->T());
1385 double err = std::abs(p_EOS - p_anc) / p_anc;
1386 CAPTURE(name);
1387 CAPTURE("pL");
1388 CAPTURE(p_EOS);
1389 CAPTURE(p_anc);
1390 CAPTURE(AS->T());
1391 CHECK(err < 0.02);
1392 }
1393 void check_pV(const shared_ptr<CoolProp::AbstractState>& AS) {
1394 double p_EOS = AS->saturated_liquid_keyed_output(iP);
1395 double p_anc = AS->saturation_ancillary(CoolProp::iP, 1, CoolProp::iT, AS->T());
1396 double err = std::abs(p_EOS - p_anc) / p_anc;
1397 CAPTURE(name);
1398 CAPTURE("pV");
1399 CAPTURE(p_EOS);
1400 CAPTURE(p_anc);
1401 CAPTURE(AS->T());
1402 CHECK(err < 0.02);
1403 }
1404 void check_rhoL(const shared_ptr<CoolProp::AbstractState>& AS) {
1405 double rho_EOS = AS->saturated_liquid_keyed_output(iDmolar);
1406 double rho_anc = AS->saturation_ancillary(CoolProp::iDmolar, 0, CoolProp::iT, AS->T());
1407 double err = std::abs(rho_EOS - rho_anc) / rho_anc;
1408 CAPTURE("rhoL");
1409 CAPTURE(name);
1410 CAPTURE(rho_EOS);
1411 CAPTURE(rho_anc);
1412 CAPTURE(AS->T());
1413 CHECK(err < 0.03);
1414 }
1415 void check_rhoV(const shared_ptr<CoolProp::AbstractState>& AS) {
1416 double rho_EOS = AS->saturated_vapor_keyed_output(iDmolar);
1417 double rho_anc = AS->saturation_ancillary(CoolProp::iDmolar, 1, CoolProp::iT, AS->T());
1418 double err = std::abs(rho_EOS - rho_anc) / rho_anc;
1419 CAPTURE("rhoV");
1420 CAPTURE(name);
1421 CAPTURE(rho_EOS);
1422 CAPTURE(rho_anc);
1423 CAPTURE(AS->T());
1424 CHECK(err < 0.03);
1425 }
1426};
1427// Disabled because either they have a superancillary, and the ancillaries should not be used,
1428// or they are a pure fluid and superancillaries are not developed
1429//TEST_CASE_METHOD(AncillaryFixture, "Ancillary functions", "[ancillary]") {
1430// run_checks();
1431//};
1432
1433TEST_CASE("Triple point checks", "[triple_point]") {
1434 std::vector<std::string> fluids = strsplit(CoolProp::get_global_param_string("fluids_list"), ',');
1435 for (std::size_t i = 0; i < fluids.size(); ++i) {
1436 std::vector<std::string> names(1, fluids[i]);
1437 shared_ptr<CoolProp::HelmholtzEOSMixtureBackend> HEOS(new CoolProp::HelmholtzEOSMixtureBackend(names));
1438 // Skip pseudo-pure
1439 if (!HEOS->is_pure()) {
1440 continue;
1441 }
1442
1443 std::ostringstream ss1;
1444 ss1 << "Minimum saturation temperature state matches for liquid " << fluids[i];
1445 SECTION(ss1.str(), "") {
1446 REQUIRE_NOTHROW(HEOS->update(CoolProp::QT_INPUTS, 0, HEOS->Ttriple()));
1447 double p_EOS = HEOS->p();
1448 double p_sat_min_liquid = HEOS->get_components()[0].EOS().sat_min_liquid.p;
1449 double err_sat_min_liquid = std::abs(p_EOS - p_sat_min_liquid) / p_sat_min_liquid;
1450 CAPTURE(p_EOS);
1451 CAPTURE(p_sat_min_liquid);
1452 CAPTURE(err_sat_min_liquid);
1453 if (p_EOS < 1e-3) {
1454 continue;
1455 } // Skip very low pressure below 1 mPa
1456 CHECK(err_sat_min_liquid < 1e-3);
1457 }
1458 std::ostringstream ss2;
1459 ss2 << "Minimum saturation temperature state matches for vapor " << fluids[i];
1460 SECTION(ss2.str(), "") {
1461 REQUIRE_NOTHROW(HEOS->update(CoolProp::QT_INPUTS, 1, HEOS->Ttriple()));
1462
1463 double p_EOS = HEOS->p();
1464 double p_sat_min_vapor = HEOS->get_components()[0].EOS().sat_min_vapor.p;
1465 double err_sat_min_vapor = std::abs(p_EOS - p_sat_min_vapor) / p_sat_min_vapor;
1466 CAPTURE(p_EOS);
1467 CAPTURE(p_sat_min_vapor);
1468 CAPTURE(err_sat_min_vapor);
1469 if (p_EOS < 1e-3) {
1470 continue;
1471 } // Skip very low pressure below 1 mPa
1472 CHECK(err_sat_min_vapor < 1e-3);
1473 }
1474 std::ostringstream ss3;
1475 ss3 << "Minimum saturation temperature state matches for vapor " << fluids[i];
1476 SECTION(ss3.str(), "") {
1477 if (HEOS->p_triple() < 10) {
1478 continue;
1479 }
1480 REQUIRE_NOTHROW(HEOS->update(CoolProp::PQ_INPUTS, HEOS->p_triple(), 1));
1481
1482 double T_EOS = HEOS->T();
1483 double T_sat_min_vapor = HEOS->get_components()[0].EOS().sat_min_vapor.T;
1484 double err_sat_min_vapor = std::abs(T_EOS - T_sat_min_vapor);
1485 CAPTURE(T_EOS);
1486 CAPTURE(T_sat_min_vapor);
1487 CAPTURE(err_sat_min_vapor);
1488 CHECK(err_sat_min_vapor < 1e-3);
1489 }
1490 std::ostringstream ss4;
1491 ss4 << "Minimum saturation temperature state matches for liquid " << fluids[i];
1492 SECTION(ss4.str(), "") {
1493 if (HEOS->p_triple() < 10) {
1494 continue;
1495 }
1496 REQUIRE_NOTHROW(HEOS->update(CoolProp::PQ_INPUTS, HEOS->p_triple(), 0));
1497 double T_EOS = HEOS->T();
1498 double T_sat_min_vapor = HEOS->get_components()[0].EOS().sat_min_vapor.T;
1499 double err_sat_min_vapor = std::abs(T_EOS - T_sat_min_vapor);
1500 CAPTURE(T_EOS);
1501 CAPTURE(T_sat_min_vapor);
1502 CAPTURE(err_sat_min_vapor);
1503 CHECK(err_sat_min_vapor < 1e-3);
1504 }
1505 // std::ostringstream ss2;
1506 // ss2 << "Liquid density error < 3% for fluid " << fluids[i] << " at " << T << " K";
1507 // SECTION(ss2.str(), "")
1508 // {
1509 // double rho_EOS = AS->rhomolar();
1510 // double rho_anc = AS->saturation_ancillary(CoolProp::iDmolar, 0, CoolProp::iT, T);
1511 // double err = std::abs(rho_EOS-rho_anc)/rho_anc;
1512 // CAPTURE(rho_EOS);
1513 // CAPTURE(rho_anc);
1514 // CAPTURE(T);
1515 // CHECK(err < 0.03);
1516 // }
1517 // std::ostringstream ss3;
1518 // ss3 << "Vapor density error < 3% for fluid " << fluids[i] << " at " << T << " K";
1519 // SECTION(ss3.str(), "")
1520 // {
1521 // double rho_EOS = AS->rhomolar();
1522 // double rho_anc = AS->saturation_ancillary(CoolProp::iDmolar, 1, CoolProp::iT, T);
1523 // double err = std::abs(rho_EOS-rho_anc)/rho_anc;
1524 // CAPTURE(rho_EOS);
1525 // CAPTURE(rho_anc);
1526 // CAPTURE(T);
1527 // CHECK(err < 0.03);
1528 // }
1529 }
1530}
1531
1532class SatTFixture
1533{
1534 public:
1535 std::string name;
1536 double Tc;
1537 void run_checks() {
1538 std::vector<std::string> fluids = strsplit(CoolProp::get_global_param_string("fluids_list"), ',');
1539 for (std::size_t i = 0; i < fluids.size(); ++i) {
1540 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", fluids[i]));
1541 auto* rHEOS = dynamic_cast<HelmholtzEOSMixtureBackend*>(AS.get());
1542 if (!rHEOS->is_pure()){
1543 continue;
1544 }
1545 do_sat(AS);
1546 }
1547 }
1548 void do_sat(shared_ptr<CoolProp::AbstractState>& AS) {
1549 Tc = AS->T_critical();
1550 name = strjoin(AS->fluid_names(), "&");
1551 check_at_Tc(AS);
1552 double Tt = AS->Ttriple();
1553 if (AS->fluid_param_string("pure") == "true") {
1554 Tc = std::min(Tc, AS->T_reducing());
1555 }
1556 for (double j = 0.1; j > 1e-10; j /= 10) {
1557 check_QT(AS, Tc - j);
1558 }
1559 }
1560 void check_at_Tc(const shared_ptr<CoolProp::AbstractState>& AS) {
1561 CAPTURE("Check @ Tc");
1562 CAPTURE(name);
1563 CHECK_NOTHROW(AS->update(QT_INPUTS, 0, Tc));
1564 }
1565 void check_QT(const shared_ptr<CoolProp::AbstractState>& AS, double T) {
1566 std::string test_name = "Check --> Tc";
1567 CAPTURE(test_name);
1568 CAPTURE(name);
1569 CAPTURE(T);
1570 CHECK_NOTHROW(AS->update(QT_INPUTS, 0, T));
1571 }
1572};
1573TEST_CASE_METHOD(SatTFixture, "Test that saturation solvers solve all the way to T = Tc", "[sat_T_to_Tc]") {
1574 run_checks();
1575};
1576
1577TEST_CASE("Check mixtures with fluid name aliases", "[mixture_name_aliasing]") {
1578 shared_ptr<CoolProp::AbstractState> AS1, AS2;
1579 AS1.reset(CoolProp::AbstractState::factory("HEOS", "EBENZENE&P-XYLENE"));
1580 AS2.reset(CoolProp::AbstractState::factory("HEOS", "EthylBenzene&P-XYLENE"));
1581 REQUIRE(AS1->fluid_names().size() == AS2->fluid_names().size());
1582 std::size_t N = AS1->fluid_names().size();
1583 for (std::size_t i = 0; i < N; ++i) {
1584 CAPTURE(i);
1585 CHECK(AS1->fluid_names()[i] == AS2->fluid_names()[i]);
1586 }
1587}
1588
1589TEST_CASE("Predefined mixtures", "[predefined_mixtures]") {
1590 SECTION("PropsSI") {
1591 double val = PropsSI("Dmolar", "P", 101325, "T", 300, "Air.mix");
1592 std::string err = get_global_param_string("errstring");
1593 CAPTURE(val);
1594 CAPTURE(err);
1595 CHECK(ValidNumber(val));
1596 }
1597}
1598TEST_CASE("Test that reference states yield proper values using high-level interface", "[reference_states]") {
1599 struct ref_entry
1600 {
1601 std::string name;
1602 double hmass, smass;
1603 std::string in1;
1604 double val1;
1605 std::string in2;
1606 double val2;
1607 };
1608 std::string fluids[] = {"n-Propane", "R134a", "R124"};
1609 ref_entry entries[3] = {{"IIR", 200000, 1000, "T", 273.15, "Q", 0}, {"ASHRAE", 0, 0, "T", 233.15, "Q", 0}, {"NBP", 0, 0, "P", 101325, "Q", 0}};
1610 for (std::size_t i = 0; i < 3; ++i) {
1611 for (std::size_t j = 0; j < 3; ++j) {
1612 std::ostringstream ss1;
1613 ss1 << "Check state for " << fluids[i] << " for " + entries[j].name + " reference state ";
1614 SECTION(ss1.str(), "") {
1615 // First reset the reference state
1616 set_reference_stateS(fluids[i], "DEF");
1617 // Then set to desired reference state
1618 set_reference_stateS(fluids[i], entries[j].name);
1619 // Calculate the values
1620 double hmass = PropsSI("Hmass", entries[j].in1, entries[j].val1, entries[j].in2, entries[j].val2, fluids[i]);
1621 double smass = PropsSI("Smass", entries[j].in1, entries[j].val1, entries[j].in2, entries[j].val2, fluids[i]);
1622 CHECK(std::abs(hmass - entries[j].hmass) < 1e-8);
1623 CHECK(std::abs(smass - entries[j].smass) < 1e-8);
1624 // Then reset the reference state
1625 set_reference_stateS(fluids[i], "DEF");
1626 }
1627 }
1628 }
1629}
1630TEST_CASE("Test that reference states yield proper values using low-level interface", "[reference_states]") {
1631 struct ref_entry
1632 {
1633 std::string name;
1634 double hmass, smass;
1635 parameters in1;
1636 double val1;
1637 parameters in2;
1638 double val2;
1639 };
1640 std::string fluids[] = {"n-Propane", "R134a", "R124"};
1641 ref_entry entries[3] = {{"IIR", 200000, 1000, iT, 273.15, iQ, 0}, {"ASHRAE", 0, 0, iT, 233.15, iQ, 0}, {"NBP", 0, 0, iP, 101325, iQ, 0}};
1642 for (std::size_t i = 0; i < 3; ++i) {
1643 for (std::size_t j = 0; j < 3; ++j) {
1644 std::ostringstream ss1;
1645 ss1 << "Check state for " << fluids[i] << " for " + entries[j].name + " reference state ";
1646 SECTION(ss1.str(), "") {
1647 double val1, val2;
1648 input_pairs pair = generate_update_pair(entries[j].in1, entries[j].val1, entries[j].in2, entries[j].val2, val1, val2);
1649 // Generate a state instance
1650 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", fluids[i]));
1651 AS->update(pair, val1, val2);
1652 double hmass0 = AS->hmass();
1653 double smass0 = AS->smass();
1654 // First reset the reference state
1655 set_reference_stateS(fluids[i], "DEF");
1656 AS->update(pair, val1, val2);
1657 double hmass00 = AS->hmass();
1658 double smass00 = AS->smass();
1659 CHECK(std::abs(hmass00 - hmass0) < 1e-10);
1660 CHECK(std::abs(smass00 - smass0) < 1e-10);
1661
1662 // Then set to desired reference state
1663 set_reference_stateS(fluids[i], entries[j].name);
1664
1665 // Should not change existing instance
1666 AS->clear();
1667 AS->update(pair, val1, val2);
1668 double hmass1 = AS->hmass();
1669 double smass1 = AS->smass();
1670 CHECK(std::abs(hmass1 - hmass0) < 1e-10);
1671 CHECK(std::abs(smass1 - smass0) < 1e-10);
1672
1673 // New instance - should get updated reference state
1674 shared_ptr<CoolProp::AbstractState> AS2(CoolProp::AbstractState::factory("HEOS", fluids[i]));
1675 AS2->update(pair, val1, val2);
1676 double hmass2 = AS2->hmass();
1677 double smass2 = AS2->smass();
1678 CHECK(std::abs(hmass2 - entries[j].hmass) < 1e-8);
1679 CHECK(std::abs(smass2 - entries[j].smass) < 1e-8);
1680
1681 // Then reset the reference state
1682 set_reference_stateS(fluids[i], "DEF");
1683 }
1684 }
1685 }
1686}
1687
1688class FixedStateFixture
1689{
1690 public:
1691 void run_fluid(const std::string& fluid, const std::string& state, const std::string& ref_state) {
1692
1693 // Skip impossible reference states
1694 if (Props1SI("Ttriple", fluid) > 233.15 && ref_state == "ASHRAE") {
1695 return;
1696 }
1697 if (Props1SI("Tcrit", fluid) < 233.15 && ref_state == "ASHRAE") {
1698 return;
1699 }
1700 if (Props1SI("Tcrit", fluid) < 273.15 && ref_state == "IIR") {
1701 return;
1702 }
1703 if (Props1SI("Ttriple", fluid) > 273.15 && ref_state == "IIR") {
1704 return;
1705 }
1706 if (Props1SI("ptriple", fluid) > 101325 && ref_state == "NBP") {
1707 return;
1708 }
1709
1710 // First reset the reference state
1711 if (ref_state != "DEF") {
1712 set_reference_stateS(fluid, "DEF");
1713 try {
1714 // Then try to set to the specified reference state
1715 set_reference_stateS(fluid, ref_state);
1716 } catch (std::exception& e) {
1717 // Then set the reference state back to the default
1718 set_reference_stateS(fluid, "DEF");
1719 CAPTURE(e.what());
1720 REQUIRE(false);
1721 }
1722 }
1723
1724 std::ostringstream name;
1725 name << "Check state for " << state << " for " << fluid << " for reference state " << ref_state;
1726 CAPTURE(name.str());
1727
1728 std::vector<std::string> fl(1, fluid);
1729 shared_ptr<CoolProp::HelmholtzEOSMixtureBackend> HEOS(new CoolProp::HelmholtzEOSMixtureBackend(fl));
1730
1731 // Skip the saturation maxima states for pure fluids
1732 if (HEOS->is_pure() && (state == "max_sat_T" || state == "max_sat_p")) {
1733 return;
1734 }
1735
1736 // Get the state
1737 CoolProp::SimpleState _state = HEOS->calc_state(state);
1738 HEOS->specify_phase(iphase_gas); // something homogenous
1739 // Bump a tiny bit for EOS with non-analytic parts
1740 double f = 1.0;
1741 if ((fluid == "Water" || fluid == "CarbonDioxide") && (state == "reducing" || state == "critical")) {
1742 f = 1.00001;
1743 }
1744 HEOS->update(CoolProp::DmolarT_INPUTS, _state.rhomolar * f, _state.T * f);
1745 CAPTURE(_state.hmolar);
1746 CAPTURE(_state.smolar);
1747 CHECK(ValidNumber(_state.hmolar));
1748 CHECK(ValidNumber(_state.smolar));
1749 double EOS_hmolar = HEOS->hmolar();
1750 double EOS_smolar = HEOS->smolar();
1751 CAPTURE(EOS_hmolar);
1752 CAPTURE(EOS_smolar);
1753 CHECK(std::abs(EOS_hmolar - _state.hmolar) < 1e-2);
1754 CHECK(std::abs(EOS_smolar - _state.smolar) < 1e-2);
1755 // Then set the reference state back to the default
1756 set_reference_stateS(fluid, "DEF");
1757 };
1758 void run_checks() {
1759
1760 std::vector<std::string> fluids = strsplit(CoolProp::get_global_param_string("fluids_list"), ',');
1761 for (std::size_t i = 0; i < fluids.size(); ++i) {
1762 std::string ref_state[4] = {"DEF", "IIR", "ASHRAE", "NBP"};
1763 for (std::size_t j = 0; j < 4; ++j) {
1764 std::string states[] = {"hs_anchor", "reducing", "critical", "max_sat_T", "max_sat_p", "triple_liquid", "triple_vapor"};
1765 for (std::size_t k = 0; k < 7; ++k) {
1766 run_fluid(fluids[i], states[k], ref_state[j]);
1767 }
1768 }
1769 }
1770 }
1771};
1772TEST_CASE_METHOD(FixedStateFixture, "Test that enthalpies and entropies are correct for fixed states for all reference states", "[fixed_states]") {
1773 run_checks();
1774}; // !!!! check this
1775
1776TEST_CASE("Check the first partial derivatives", "[first_saturation_partial_deriv]") {
1777 const int number_of_pairs = 10;
1778 struct pair
1779 {
1780 parameters p1, p2;
1781 };
1782 pair pairs[number_of_pairs] = {{iP, iT}, {iDmolar, iT}, {iHmolar, iT}, {iSmolar, iT}, {iUmolar, iT},
1783 {iT, iP}, {iDmolar, iP}, {iHmolar, iP}, {iSmolar, iP}, {iUmolar, iP}};
1784 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "n-Propane"));
1785 for (std::size_t i = 0; i < number_of_pairs; ++i) {
1786 // See https://groups.google.com/forum/?fromgroups#!topic/catch-forum/mRBKqtTrITU
1787 std::ostringstream ss1;
1788 ss1 << "Check first partial derivative for d(" << get_parameter_information(pairs[i].p1, "short") << ")/d("
1789 << get_parameter_information(pairs[i].p2, "short") << ")|sat";
1790 SECTION(ss1.str(), "") {
1791 AS->update(QT_INPUTS, 1, 300);
1792 CoolPropDbl p = AS->p();
1793 CoolPropDbl analytical = AS->first_saturation_deriv(pairs[i].p1, pairs[i].p2);
1794 CAPTURE(analytical);
1795 CoolPropDbl numerical;
1796 if (pairs[i].p2 == iT) {
1797 AS->update(QT_INPUTS, 1, 300 + 1e-5);
1798 CoolPropDbl v1 = AS->keyed_output(pairs[i].p1);
1799 AS->update(QT_INPUTS, 1, 300 - 1e-5);
1800 CoolPropDbl v2 = AS->keyed_output(pairs[i].p1);
1801 numerical = (v1 - v2) / (2e-5);
1802 } else if (pairs[i].p2 == iP) {
1803 AS->update(PQ_INPUTS, p + 1e-2, 1);
1804 CoolPropDbl v1 = AS->keyed_output(pairs[i].p1);
1805 AS->update(PQ_INPUTS, p - 1e-2, 1);
1806 CoolPropDbl v2 = AS->keyed_output(pairs[i].p1);
1807 numerical = (v1 - v2) / (2e-2);
1808 } else {
1809 throw ValueError();
1810 }
1811 CAPTURE(numerical);
1812 CHECK(std::abs(numerical / analytical - 1) < 1e-4);
1813 }
1814 }
1815}
1816
1817TEST_CASE("Check the second saturation derivatives", "[second_saturation_partial_deriv]") {
1818 const int number_of_pairs = 5;
1819 struct pair
1820 {
1821 parameters p1, p2, p3;
1822 };
1823 pair pairs[number_of_pairs] = {{iT, iP, iP}, {iDmolar, iP, iP}, {iHmolar, iP, iP}, {iSmolar, iP, iP}, {iUmolar, iP, iP}};
1824 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "n-Propane"));
1825 for (std::size_t i = 0; i < number_of_pairs; ++i) {
1826 // See https://groups.google.com/forum/?fromgroups#!topic/catch-forum/mRBKqtTrITU
1827 std::ostringstream ss1;
1828 ss1 << "Check second saturation derivative for d2(" << get_parameter_information(pairs[i].p1, "short") << ")/d("
1829 << get_parameter_information(pairs[i].p2, "short") << ")2|sat";
1830 SECTION(ss1.str(), "") {
1831 AS->update(QT_INPUTS, 1, 300);
1832 CoolPropDbl p = AS->p();
1833 CoolPropDbl analytical = AS->second_saturation_deriv(pairs[i].p1, pairs[i].p2, pairs[i].p3);
1834 CAPTURE(analytical);
1835 CoolPropDbl numerical;
1836 if (pairs[i].p2 == iT) {
1837 throw NotImplementedError();
1838 } else if (pairs[i].p2 == iP) {
1839 AS->update(PQ_INPUTS, p + 1e-2, 1);
1840 CoolPropDbl v1 = AS->first_saturation_deriv(pairs[i].p1, pairs[i].p2);
1841 AS->update(PQ_INPUTS, p - 1e-2, 1);
1842 CoolPropDbl v2 = AS->first_saturation_deriv(pairs[i].p1, pairs[i].p2);
1843 numerical = (v1 - v2) / (2e-2);
1844 } else {
1845 throw ValueError();
1846 }
1847 CAPTURE(numerical);
1848 CHECK(std::abs(numerical / analytical - 1) < 1e-4);
1849 }
1850 }
1851}
1852
1853TEST_CASE("Check the first two-phase derivative", "[first_two_phase_deriv]") {
1854 const int number_of_pairs = 4;
1855 struct pair
1856 {
1857 parameters p1, p2, p3;
1858 };
1859 pair pairs[number_of_pairs] = {{iDmass, iP, iHmass}, {iDmolar, iP, iHmolar}, {iDmolar, iHmolar, iP}, {iDmass, iHmass, iP}};
1860 shared_ptr<CoolProp::HelmholtzEOSBackend> AS(new CoolProp::HelmholtzEOSBackend("n-Propane"));
1861 for (std::size_t i = 0; i < number_of_pairs; ++i) {
1862 // See https://groups.google.com/forum/?fromgroups#!topic/catch-forum/mRBKqtTrITU
1863 std::ostringstream ss1;
1864 ss1 << "for (" << get_parameter_information(pairs[i].p1, "short") << ", " << get_parameter_information(pairs[i].p2, "short") << ", "
1865 << get_parameter_information(pairs[i].p3, "short") << ")";
1866 SECTION(ss1.str(), "") {
1867 AS->update(QT_INPUTS, 0.3, 300);
1868 CoolPropDbl numerical;
1869 CoolPropDbl analytical = AS->first_two_phase_deriv(pairs[i].p1, pairs[i].p2, pairs[i].p3);
1870 CAPTURE(analytical);
1871
1872 CoolPropDbl out1, out2;
1873 CoolPropDbl v2base, v3base;
1874 v2base = AS->keyed_output(pairs[i].p2);
1875 v3base = AS->keyed_output(pairs[i].p3);
1876 CoolPropDbl v2plus = v2base * 1.001;
1877 CoolPropDbl v2minus = v2base * 0.999;
1878 CoolProp::input_pairs input_pair1 = generate_update_pair(pairs[i].p2, v2plus, pairs[i].p3, v3base, out1, out2);
1879 AS->update(input_pair1, out1, out2);
1880 CoolPropDbl v1 = AS->keyed_output(pairs[i].p1);
1881 CoolProp::input_pairs input_pair2 = generate_update_pair(pairs[i].p2, v2minus, pairs[i].p3, v3base, out1, out2);
1882 AS->update(input_pair2, out1, out2);
1883 CoolPropDbl v2 = AS->keyed_output(pairs[i].p1);
1884
1885 numerical = (v1 - v2) / (v2plus - v2minus);
1886 CAPTURE(numerical);
1887 CHECK(std::abs(numerical / analytical - 1) < 1e-4);
1888 }
1889 }
1890}
1891
1892TEST_CASE("Check the second two-phase derivative", "[second_two_phase_deriv]") {
1893 SECTION("d2rhodhdp", "") {
1894 shared_ptr<CoolProp::HelmholtzEOSBackend> AS(new CoolProp::HelmholtzEOSBackend("n-Propane"));
1895 AS->update(QT_INPUTS, 0.3, 300);
1896 CoolPropDbl analytical = AS->second_two_phase_deriv(iDmolar, iHmolar, iP, iP, iHmolar);
1897 CAPTURE(analytical);
1898 CoolPropDbl pplus = AS->p() * 1.001, pminus = AS->p() * 0.999, h = AS->hmolar();
1899 AS->update(HmolarP_INPUTS, h, pplus);
1900 CoolPropDbl v1 = AS->first_two_phase_deriv(iDmolar, iHmolar, iP);
1901 AS->update(HmolarP_INPUTS, h, pminus);
1902 CoolPropDbl v2 = AS->first_two_phase_deriv(iDmolar, iHmolar, iP);
1903 CoolPropDbl numerical = (v1 - v2) / (pplus - pminus);
1904 CAPTURE(numerical);
1905 CHECK(std::abs(numerical / analytical - 1) < 1e-6);
1906 }
1907 SECTION("d2rhodhdp using mass", "") {
1908 shared_ptr<CoolProp::HelmholtzEOSBackend> AS(new CoolProp::HelmholtzEOSBackend("n-Propane"));
1909 AS->update(QT_INPUTS, 0.3, 300);
1910 CoolPropDbl analytical = AS->second_two_phase_deriv(iDmass, iHmass, iP, iP, iHmass);
1911 CAPTURE(analytical);
1912 CoolPropDbl pplus = AS->p() * 1.001, pminus = AS->p() * 0.999, h = AS->hmass();
1913 AS->update(HmassP_INPUTS, h, pplus);
1914 CoolPropDbl v1 = AS->first_two_phase_deriv(iDmass, iHmass, iP);
1915 AS->update(HmassP_INPUTS, h, pminus);
1916 CoolPropDbl v2 = AS->first_two_phase_deriv(iDmass, iHmass, iP);
1917 CoolPropDbl numerical = (v1 - v2) / (pplus - pminus);
1918 CAPTURE(numerical);
1919 CHECK(std::abs(numerical / analytical - 1) < 1e-6);
1920 }
1921}
1922
1923TEST_CASE("Check the first two-phase derivative using splines", "[first_two_phase_deriv_splined]") {
1972 using paramtuple = std::tuple<parameters, parameters, parameters>;
1973
1974 SECTION("Compared with reference data"){
1975
1976 std::map<paramtuple, double> pairs = {
1977 {{iDmass, iP, iHmass}, 0.00056718665544440146},
1978 {{iDmass, iHmass, iP}, -0.0054665229407696173},
1979 {{iDmass, iDmass, iDmass}, 179.19799206447755}
1980 };
1981
1982 std::unique_ptr<CoolProp::HelmholtzEOSBackend> AS(new CoolProp::HelmholtzEOSBackend("n-Propane"));
1983 for (auto& [pair, expected_value]: pairs) {
1984 // See https://groups.google.com/forum/?fromgroups#!topic/catch-forum/mRBKqtTrITU
1985 std::ostringstream ss1;
1986 auto& [p1, p2, p3] = pair;
1987 ss1 << "for (" << get_parameter_information(p1, "short") << ", " << get_parameter_information(p2, "short") << ", "
1988 << get_parameter_information(p3, "short") << ")";
1989 double x_end = 0.3;
1990 SECTION(ss1.str(), "") {
1991 AS->update(QT_INPUTS, 0.2, 300);
1992 CoolPropDbl analytical = AS->first_two_phase_deriv_splined(p1, p2, p3, x_end);
1993 CAPTURE(analytical);
1994 CHECK(std::abs(expected_value / analytical - 1) < 1e-8);
1995 }
1996 }
1997 }
1998 SECTION("Finite diffs"){
1999 std::vector<paramtuple> pairs = {{iDmass, iHmass, iP}, {iDmolar, iHmolar, iP}};//, {iDmass, iHmass, iP}};
2000 std::unique_ptr<CoolProp::HelmholtzEOSBackend> AS(new CoolProp::HelmholtzEOSBackend("n-Propane"));
2001 for (auto& pair: pairs) {
2002 // See https://groups.google.com/forum/?fromgroups#!topic/catch-forum/mRBKqtTrITU
2003 std::ostringstream ss1;
2004 auto& [p1, p2, p3] = pair;
2005 ss1 << "for (" << get_parameter_information(p1, "short") << ", " << get_parameter_information(p2, "short") << ", "
2006 << get_parameter_information(p3, "short") << ")";
2007 double x_end = 0.3;
2008 SECTION(ss1.str(), "") {
2009 AS->update(QT_INPUTS, 0.2, 300);
2010 CoolPropDbl numerical;
2011 CoolPropDbl analytical = AS->first_two_phase_deriv_splined(p1, p2, p3, x_end);
2012 CAPTURE(analytical);
2013
2014 CoolPropDbl out1, out2;
2015 CoolPropDbl v2base, v3base;
2016 v2base = AS->keyed_output(p2);
2017 v3base = AS->keyed_output(p3);
2018 CoolPropDbl v2plus = v2base * 1.00001;
2019 CoolPropDbl v2minus = v2base * 0.99999;
2020
2021 // Get the density (molar or specific) for the second variable shifted up with the third variable
2022 // held constant
2023 CoolProp::input_pairs input_pair1 = generate_update_pair(p2, v2plus, p3, v3base, out1, out2);
2024 AS->update(input_pair1, out1, out2);
2025 CoolPropDbl D1 = AS->first_two_phase_deriv_splined(p1, p1, p1, x_end);
2026
2027 // Get the density (molar or specific) for the second variable shifted down with the third variable
2028 // held constant
2029 CoolProp::input_pairs input_pair2 = generate_update_pair(p2, v2minus, p3, v3base, out1, out2);
2030 AS->update(input_pair2, out1, out2);
2031 CoolPropDbl D2 = AS->first_two_phase_deriv_splined(p1, p1, p1, x_end);
2032
2033 numerical = (D1 - D2) / (v2plus - v2minus);
2034 CAPTURE(numerical);
2035 CHECK(std::abs(numerical / analytical - 1) < 1e-8);
2036 }
2037 }
2038 }
2039}
2040
2041TEST_CASE("Check the phase flags", "[phase]") {
2042 SECTION("subcooled liquid") {
2043 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "Water"));
2044 AS->update(PT_INPUTS, 101325, 300);
2045 CHECK(AS->phase() == iphase_liquid);
2046 }
2047 SECTION("superheated gas") {
2048 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "Water"));
2049 AS->update(PT_INPUTS, 101325, 400);
2050 CHECK(AS->phase() == iphase_gas);
2051 }
2052 SECTION("supercritical gas") {
2053 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "Water"));
2054 AS->update(PT_INPUTS, 1e5, 800);
2055 CHECK(AS->phase() == iphase_supercritical_gas);
2056 }
2057 SECTION("supercritical liquid") {
2058 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "Water"));
2059 AS->update(PT_INPUTS, 1e8, 500);
2060 CHECK(AS->phase() == iphase_supercritical_liquid);
2061 }
2062 SECTION("supercritical") {
2063 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "Water"));
2064 AS->update(PT_INPUTS, 1e8, 800);
2065 CHECK(AS->phase() == iphase_supercritical);
2066 }
2067}
2068
2069TEST_CASE("Check the changing of reducing function constants", "[reducing]") {
2070 double z0 = 0.2;
2071 std::vector<double> z(2);
2072 z[0] = z0;
2073 z[1] = 1 - z[0];
2074 shared_ptr<CoolProp::AbstractState> AS1(CoolProp::AbstractState::factory("HEOS", "Methane&Ethane"));
2075 shared_ptr<CoolProp::AbstractState> AS2(CoolProp::AbstractState::factory("HEOS", "Methane&Ethane"));
2076 AS1->set_mole_fractions(z);
2077 AS2->set_mole_fractions(z);
2078 std::vector<CoolProp::CriticalState> pts1 = AS1->all_critical_points();
2079 double gammaT = AS2->get_binary_interaction_double(0, 1, "gammaT");
2080 AS2->set_binary_interaction_double(0, 1, "gammaT", gammaT * 0.7);
2081 std::vector<CoolProp::CriticalState> pts2 = AS2->all_critical_points();
2082 double Tdiff = abs(pts2[0].T - pts1[0].T);
2083 CHECK(Tdiff > 1e-3); // Make sure that it actually got the change to the interaction parameters
2084}
2085
2086TEST_CASE("Check the PC-SAFT pressure function", "[pcsaft_pressure]") {
2087 double p = 101325.;
2088 double p_calc = CoolProp::PropsSI("P", "T", 320., "Dmolar", 9033.114359706229, "PCSAFT::TOLUENE");
2089 CHECK(abs((p_calc / p) - 1) < 1e-5);
2090
2091 p_calc = CoolProp::PropsSI("P", "T", 274., "Dmolar", 55530.40675319466, "PCSAFT::WATER");
2092 CHECK(abs((p_calc/p) - 1) < 1e-5);
2093
2094 p_calc = CoolProp::PropsSI("P", "T", 305., "Dmolar", 16965.6697209874,"PCSAFT::ACETIC ACID");
2095 CHECK(abs((p_calc/p) - 1) < 1e-5);
2096
2097 p_calc = CoolProp::PropsSI("P", "T", 240., "Dmolar", 15955.50941242, "PCSAFT::DIMETHYL ETHER");
2098 CHECK(abs((p_calc/p) - 1) < 1e-5);
2099
2100 p_calc = CoolProp::PropsSI("P", "T", 298.15, "Dmolar", 9368.903838750752, "PCSAFT::METHANOL[0.055]&CYCLOHEXANE[0.945]");
2101 CHECK(abs((p_calc/p) - 1) < 1e-5);
2102
2103 //p_calc = CoolProp::PropsSI("P", "T", 298.15, "Dmolar", 55757.07260200306, "PCSAFT::Na+[0.010579869455908]&Cl-[0.010579869455908]&WATER[0.978840261088184]");
2104 //CHECK(abs((p_calc/p) - 1) < 1e-5);
2105
2106 p = CoolProp::PropsSI("P", "T", 100., "Q", 0, "PCSAFT::PROPANE");
2107 double rho = 300;
2108 double phase = CoolProp::PropsSI("Phase", "T", 100., "Dmolar", rho, "PCSAFT::PROPANE");
2109 CHECK(phase == get_phase_index("phase_twophase"));
2110 p_calc = CoolProp::PropsSI("P", "T", 100, "Dmolar", rho, "PCSAFT::PROPANE");
2111 CHECK(abs((p_calc / p) - 1) < 1e-4);
2112}
2113
2114TEST_CASE("Check the PC-SAFT density function", "[pcsaft_density]") {
2115 double den = 9033.114209728405;
2116 double den_calc = CoolProp::PropsSI("Dmolar", "T|liquid", 320., "P", 101325., "PCSAFT::TOLUENE");
2117 CHECK(abs((den_calc / den) - 1) < 1e-5);
2118
2119 den = 55530.40512318346;
2120 den_calc = CoolProp::PropsSI("Dmolar", "T|liquid", 274., "P", 101325, "PCSAFT::WATER");
2121 CHECK(abs((den_calc / den) - 1) < 1e-5);
2122
2123 den = 17240.; // source: DIPPR correlation
2124 den_calc = CoolProp::PropsSI("Dmolar","T|liquid",305.,"P",101325,"PCSAFT::ACETIC ACID");
2125 CHECK(abs((den_calc/den) - 1) < 2e-2);
2126
2127 den = 15955.509146801696;
2128 den_calc = CoolProp::PropsSI("Dmolar","T|liquid",240.,"P",101325,"PCSAFT::DIMETHYL ETHER");
2129 CHECK(abs((den_calc/den) - 1) < 1e-5);
2130
2131 den = 9368.90368306872;
2132 den_calc = CoolProp::PropsSI("Dmolar", "T|liquid", 298.15, "P", 101325, "PCSAFT::METHANOL[0.055]&CYCLOHEXANE[0.945]");
2133 CHECK(abs((den_calc / den) - 1) < 1e-5);
2134
2135 den = 55740.157290833515;
2136 den_calc = CoolProp::PropsSI("Dmolar", "T|liquid", 298.15, "P", 101325, "PCSAFT::Na+[0.010579869455908]&Cl-[0.010579869455908]&WATER[0.978840261088184]");
2137 CHECK(abs((den_calc / den) - 1) < 1e-5);
2138
2139 den = 16621.0;
2140 den_calc = CoolProp::PropsSI("Dmolar", "T|liquid", 85.525, "P", 1.7551e-4, "PCSAFT::PROPANE");
2141 CHECK(abs((den_calc / den) - 1) < 1e-2);
2142
2143 den = 1.9547e-7;
2144 den_calc = CoolProp::PropsSI("Dmolar", "T|gas", 85.525, "P", 1.39e-4, "PCSAFT::PROPANE");
2145 CHECK(abs((den_calc / den) - 1) < 1e-2);
2146
2147 den = 11346.0;
2148 den_calc = CoolProp::PropsSI("Dmolar", "T|liquid", 293, "P", 833240, "PCSAFT::PROPANE");
2149 CHECK(abs((den_calc / den) - 1) < 1e-2);
2150
2151 den = 623.59;
2152 den_calc = CoolProp::PropsSI("Dmolar","T|liquid", 430,"P", 2000000, "PCSAFT::PROPANE");
2153 CHECK(abs((den_calc/den) - 1) < 1e-2);
2154}
2155
2156TEST_CASE("Check the PC-SAFT residual enthalpy function", "[pcsaft_enthalpy]") {
2157 double h = -36809.962122036086;
2158 double h_calc = CoolProp::PropsSI("Hmolar_residual", "T|liquid", 325., "Dmolar", 8983.377722763931, "PCSAFT::TOLUENE");
2159 CHECK(abs((h_calc / h) - 1) < 1e-5);
2160
2161 h = -362.6832840695562;
2162 h_calc = CoolProp::PropsSI("Hmolar_residual", "T|gas", 325., "Dmolar", 39.44490805826904, "PCSAFT::TOLUENE");
2163 CHECK(abs((h_calc / h) - 1) < 1e-5);
2164
2165 h = -38925.302571456035;
2166 h_calc = CoolProp::PropsSI("Hmolar_residual","T|liquid",325.,"Dmolar", 16655.853047419932,"PCSAFT::ACETIC ACID");
2167 CHECK(abs((h_calc/h) - 1) < 1e-5);
2168
2169 h = -15393.870073928741;
2170 h_calc = CoolProp::PropsSI("Hmolar_residual", "T|gas", 325., "Dmolar", 85.70199446609787, "PCSAFT::ACETIC ACID");
2171 CHECK(abs((h_calc / h) - 1) < 1e-5);
2172
2173 h = -18242.128097841978;
2174 h_calc = CoolProp::PropsSI("Hmolar_residual","T|liquid",325.,"Dmolar", 13141.475980937616,"PCSAFT::DIMETHYL ETHER");
2175 CHECK(abs((h_calc/h) - 1) < 1e-5);
2176
2177 h = -93.819615173017169;
2178 h_calc = CoolProp::PropsSI("Hmolar_residual","T|gas",325.,"Dmolar", 37.963459290365265,"PCSAFT::DIMETHYL ETHER");
2179 CHECK(abs((h_calc/h) - 1) < 1e-5);
2180
2181 // checks based on values from the HEOS backend
2182 h = CoolProp::PropsSI("Hmolar_residual", "T|liquid", 325., "Dmolar", 8983.377722763931, "HEOS::TOLUENE");
2183 h_calc = CoolProp::PropsSI("Hmolar_residual", "T|liquid", 325., "Dmolar", 8983.377722763931, "PCSAFT::TOLUENE");
2184 CHECK(abs(h_calc - h) < 600.);
2185
2186 h = CoolProp::PropsSI("Hmolar_residual", "T|gas", 325., "Dmolar", 39.44490805826904, "HEOS::TOLUENE");
2187 h_calc = CoolProp::PropsSI("Hmolar_residual", "T|gas", 325., "Dmolar", 39.44490805826904, "PCSAFT::TOLUENE");
2188 CHECK(abs(h_calc - h) < 600.);
2189
2190 h = CoolProp::PropsSI("Hmolar_residual", "T|liquid", 325., "Dmolar", 54794.1, "HEOS::WATER");
2191 h_calc = CoolProp::PropsSI("Hmolar_residual", "T|liquid", 325., "Dmolar", 54794.1, "PCSAFT::WATER");
2192 CHECK(abs(h_calc - h) < 600.);
2193
2194 h = CoolProp::PropsSI("Hmolar_residual", "T|gas", 325., "Dmolar", 0.370207, "HEOS::WATER");
2195 h_calc = CoolProp::PropsSI("Hmolar_residual", "T|gas", 325., "Dmolar", 0.370207, "PCSAFT::WATER");
2196 CHECK(abs(h_calc - h) < 600.);
2197}
2198
2199TEST_CASE("Check the PC-SAFT residual entropy function", "[pcsaft_entropy]") {
2200 // checks based on values from working PC-SAFT code
2201 double s = -50.81694890352192;
2202 double s_calc = CoolProp::PropsSI("Smolar_residual", "T|liquid", 325., "Dmolar", 8983.377722763931, "PCSAFT::TOLUENE");
2203 CHECK(abs((s_calc / s) - 1) < 1e-5);
2204
2205 s = -0.2929618646219797;
2206 s_calc = CoolProp::PropsSI("Smolar_residual", "T|gas", 325., "Dmolar", 39.44490805826904, "PCSAFT::TOLUENE");
2207 CHECK(abs((s_calc / s) - 1) < 1e-5);
2208
2209 s = -47.42736805661422;
2210 s_calc = CoolProp::PropsSI("Smolar_residual","T|liquid",325.,"Dmolar", 16655.853047419932,"PCSAFT::ACETIC ACID");
2211 CHECK(abs((s_calc/s) - 1) < 1e-5);
2212
2213 s = -34.0021996393859;
2214 s_calc = CoolProp::PropsSI("Smolar_residual", "T|gas", 325., "Dmolar", 85.70199446609787, "PCSAFT::ACETIC ACID");
2215 CHECK(abs((s_calc / s) - 1) < 1e-5);
2216
2217 s = -26.42525828195748;
2218 s_calc = CoolProp::PropsSI("Smolar_residual","T|liquid",325.,"Dmolar", 13141.475980937616,"PCSAFT::DIMETHYL ETHER");
2219 CHECK(abs((s_calc/s) - 1) < 1e-5);
2220
2221 s = -0.08427662199177874;
2222 s_calc = CoolProp::PropsSI("Smolar_residual","T|gas",325.,"Dmolar", 37.963459290365265,"PCSAFT::DIMETHYL ETHER");
2223 CHECK(abs((s_calc/s) - 1) < 1e-5);
2224
2225 // checks based on values from the HEOS backend
2226 s = CoolProp::PropsSI("Smolar_residual", "T|liquid", 325., "Dmolar", 8983.377722763931, "HEOS::TOLUENE");
2227 s_calc = CoolProp::PropsSI("Smolar_residual", "T|liquid", 325., "Dmolar", 8983.377722763931, "PCSAFT::TOLUENE");
2228 CHECK(abs(s_calc - s) < 3.);
2229
2230 s = CoolProp::PropsSI("Smolar_residual", "T|gas", 325., "Dmolar", 39.44490805826904, "HEOS::TOLUENE");
2231 s_calc = CoolProp::PropsSI("Smolar_residual", "T|gas", 325., "Dmolar", 39.44490805826904, "PCSAFT::TOLUENE");
2232 CHECK(abs(s_calc - s) < 3.);
2233
2234 s = CoolProp::PropsSI("Smolar_residual", "T|liquid", 325., "Dmolar", 54794.1, "HEOS::WATER");
2235 s_calc = CoolProp::PropsSI("Smolar_residual", "T|liquid", 325., "Dmolar", 54794.1, "PCSAFT::WATER");
2236 CHECK(abs(s_calc - s) < 3.);
2237
2238 s = CoolProp::PropsSI("Smolar_residual", "T|gas", 325., "Dmolar", 0.370207, "HEOS::WATER");
2239 s_calc = CoolProp::PropsSI("Smolar_residual", "T|gas", 325., "Dmolar", 0.370207, "PCSAFT::WATER");
2240 CHECK(abs(s_calc - s) < 3.);
2241}
2242
2243TEST_CASE("Check the PC-SAFT residual gibbs energy function", "[pcsaft_gibbs]") {
2244 double g = -5489.471870270737;
2245 double g_calc = CoolProp::PropsSI("Gmolar_residual", "T|liquid", 325., "Dmolar", 8983.377872003264, "PCSAFT::TOLUENE");
2246 CHECK(abs((g_calc / g) - 1) < 1e-5);
2247
2248 g = -130.63592030187894;
2249 g_calc = CoolProp::PropsSI("Gmolar_residual", "T|gas", 325., "Dmolar", 39.44491269148218, "PCSAFT::TOLUENE");
2250 CHECK(abs((g_calc / g) - 1) < 1e-5);
2251
2252 g = -7038.128334100866;
2253 g_calc = CoolProp::PropsSI("Gmolar_residual","T|liquid",325.,"Dmolar", 16655.853314424,"PCSAFT::ACETIC ACID");
2254 CHECK(abs((g_calc/g) - 1) < 1e-5);
2255
2256 g = -2109.4916554917604;
2257 g_calc = CoolProp::PropsSI("Gmolar_residual", "T|gas", 325., "Dmolar", 85.70199446609787, "PCSAFT::ACETIC ACID");
2258 CHECK(abs((g_calc / g) - 1) < 1e-5);
2259
2260 g = 6178.973332408309;
2261 g_calc = CoolProp::PropsSI("Gmolar_residual","T|liquid",325.,"Dmolar", 13141.47619110254,"PCSAFT::DIMETHYL ETHER");
2262 CHECK(abs((g_calc/g) - 1) < 1e-5);
2263
2264 g = -33.038791982589615;
2265 g_calc = CoolProp::PropsSI("Gmolar_residual","T|gas",325.,"Dmolar", 37.96344503293008,"PCSAFT::DIMETHYL ETHER");
2266 CHECK(abs((g_calc/g) - 1) < 1e-5);
2267}
2268
2269TEST_CASE("Check vapor pressures calculated using PC-SAFT", "[pcsaft_vapor_pressure]") {
2270 double vp = 3290651.18080112;
2271 double vp_calc = CoolProp::PropsSI("P", "T", 572.6667, "Q", 0, "PCSAFT::TOLUENE");
2272 CHECK(abs((vp_calc / vp) - 1) < 1e-3);
2273
2274 vp = 66917.67387203;
2275 vp_calc = CoolProp::PropsSI("P", "T", 362, "Q", 0, "PCSAFT::WATER");
2276 CHECK(abs((vp_calc / vp) - 1) < 1e-3);
2277
2278 vp = 190061.78088909;
2279 vp_calc = CoolProp::PropsSI("P", "T", 413.5385, "Q", 0, "PCSAFT::ACETIC ACID");
2280 CHECK(abs((vp_calc / vp) - 1) < 1e-3);
2281
2282 vp = 622763.506195;
2283 vp_calc = CoolProp::PropsSI("P","T", 300.,"Q", 0,"PCSAFT::DIMETHYL ETHER");
2284 CHECK(abs((vp_calc/vp) - 1) < 1e-3);
2285
2286 // This test doesn't pass yet. The flash algorithm for the PC-SAFT backend is not yet robust enough.
2287 // vp = 1.7551e-4;
2288 // vp_calc = CoolProp::PropsSI("P","T",85.525,"Q", 0, "PCSAFT::PROPANE");
2289 // CHECK(abs((vp_calc/vp) - 1) < 0.1);
2290
2291 vp = 8.3324e5;
2292 vp_calc = CoolProp::PropsSI("P", "T", 293, "Q", 0, "PCSAFT::PROPANE");
2293 CHECK(abs((vp_calc / vp) - 1) < 0.01);
2294
2295 vp = 42.477e5;
2296 vp_calc = CoolProp::PropsSI("P", "T", 369.82, "Q", 0, "PCSAFT::PROPANE");
2297 CHECK(abs((vp_calc / vp) - 1) < 0.01);
2298}
2299
2300TEST_CASE("Check PC-SAFT interaction parameter functions", "[pcsaft_binary_interaction]") {
2301 std::string CAS_water = get_fluid_param_string("WATER", "CAS");
2302 std::string CAS_aacid = "64-19-7";
2303 set_mixture_binary_pair_pcsaft(CAS_water, CAS_aacid, "kij", -0.127);
2304 CHECK(atof(get_mixture_binary_pair_pcsaft(CAS_water, CAS_aacid, "kij").c_str()) == -0.127);
2305}
2306
2307TEST_CASE("Check bubble pressures calculated using PC-SAFT", "[pcsaft_bubble_pressure]")
2308{
2309 double vp = 1816840.45112607; // source: H.-M. Lin, H. M. Sebastian, J. J. Simnick, and K.-C. Chao, “Gas-liquid equilibrium in binary mixtures of methane with N-decane, benzene, and toluene,” J. Chem. Eng. Data, vol. 24, no. 2, pp. 146–149, Apr. 1979.
2310 double vp_calc = CoolProp::PropsSI("P", "T", 421.05, "Q", 0, "PCSAFT::METHANE[0.0252]&BENZENE[0.9748]");
2311 CHECK(abs((vp_calc / vp) - 1) < 1e-3);
2312
2313 // This test doesn't pass yet. The flash algorithm for the PC-SAFT backend cannot yet get a good enough initial guess value for the k values (vapor-liquid distribution ratios)
2314 // vp = 6691000; // source: Hughes TJ, Kandil ME, Graham BF, Marsh KN, Huang SH, May EF. Phase equilibrium measurements of (methane+ benzene) and (methane+ methylbenzene) at temperatures from (188 to 348) K and pressures to 13 MPa. The Journal of Chemical Thermodynamics. 2015 Jun 1;85:141-7.
2315 // vp_calc = CoolProp::PropsSI("P", "T", 348.15, "Q", 0, "PCSAFT::METHANE[0.119]&BENZENE[0.881]");
2316 // CHECK(abs((vp_calc/vp) - 1) < 1e-3);
2317
2318 vp = 96634.2439079;
2319 vp_calc = CoolProp::PropsSI("P", "T", 327.48, "Q", 0, "PCSAFT::METHANOL[0.3]&CYCLOHEXANE[0.7]");
2320 CHECK(abs((vp_calc / vp) - 1) < 1e-3);
2321
2322 // set binary interaction parameter
2323 std::string CAS_water = get_fluid_param_string("WATER", "CAS");
2324 std::string CAS_aacid = "64-19-7";
2325 try {
2326 get_mixture_binary_pair_pcsaft(CAS_water, CAS_aacid, "kij");
2327 }
2328 catch (...) {
2329 set_mixture_binary_pair_pcsaft(CAS_water, CAS_aacid, "kij", -0.127);
2330 }
2331
2332 vp = 274890.39985918;
2333 vp_calc = CoolProp::PropsSI("P", "T", 403.574, "Q", 0, "PCSAFT::WATER[0.9898662364]&ACETIC ACID[0.0101337636]");
2334 CHECK(abs((vp_calc / vp) - 1) < 1e-2);
2335
2336 vp = 72915.92217342;
2337 vp_calc = CoolProp::PropsSI("P", "T", 372.774, "Q", 0, "PCSAFT::WATER[0.2691800943]&ACETIC ACID[0.7308199057]");
2338 CHECK(abs((vp_calc / vp) - 1) < 2e-2);
2339
2340 vp = 2387.42669687;
2341 vp_calc = CoolProp::PropsSI("P","T", 298.15,"Q", 0,"PCSAFT::Na+[0.0907304774758426]&Cl-[0.0907304774758426]&WATER[0.818539045048315]");
2342 CHECK(abs((vp_calc/vp) - 1) < 0.23);
2343}
2344
2345TEST_CASE("Check bubble temperatures calculated using PC-SAFT", "[pcsaft_bubble_temperature]") {
2346 double t = 572.6667;
2347 double t_calc = CoolProp::PropsSI("T", "P", 3290651.18080112, "Q", 0, "PCSAFT::TOLUENE");
2348 CHECK(abs((t_calc / t) - 1) < 1e-3);
2349
2350 t = 362;
2351 t_calc = CoolProp::PropsSI("T", "P", 66917.67387203, "Q", 0, "PCSAFT::WATER");
2352 CHECK(abs((t_calc / t) - 1) < 1e-3);
2353
2354 t = 413.5385;
2355 t_calc = CoolProp::PropsSI("T", "P", 190061.78088909, "Q", 0, "PCSAFT::ACETIC ACID");
2356 CHECK(abs((t_calc / t) - 1) < 1e-3);
2357
2358 t = 300.;
2359 t_calc = CoolProp::PropsSI("T", "P", 623027.07850612, "Q", 0, "PCSAFT::DIMETHYL ETHER");
2360 CHECK(abs((t_calc / t) - 1) < 1e-3);
2361
2362 // This test doesn't pass yet. The flash algorithm for the PC-SAFT backend cannot yet get a good enough initial guess value for the k values (vapor-liquid distribution ratios)
2363 // t = 421.05;
2364 // t_calc = CoolProp::PropsSI("T", "P", 1816840.45112607, "Q", 0, "PCSAFT::METHANE[0.0252]&BENZENE[0.9748]");
2365 // CHECK(abs((t_calc/t) - 1) < 1e-3);
2366
2367 t = 327.48;
2368 t_calc = CoolProp::PropsSI("T", "P", 96634.2439079, "Q", 0, "PCSAFT::METHANOL[0.3]&CYCLOHEXANE[0.7]");
2369 CHECK(abs((t_calc / t) - 1) < 1e-3);
2370
2371 // set binary interaction parameter, if not already set
2372 std::string CAS_water = get_fluid_param_string("WATER","CAS");
2373 std::string CAS_aacid = "64-19-7";
2374 try {
2375 get_mixture_binary_pair_pcsaft(CAS_water, CAS_aacid, "kij");
2376 }
2377 catch (...) {
2378 set_mixture_binary_pair_pcsaft(CAS_water, CAS_aacid, "kij", -0.127);
2379 }
2380
2381 t = 403.574;
2382 t_calc = CoolProp::PropsSI("T", "P", 274890.39985918, "Q", 0, "PCSAFT::WATER[0.9898662364]&ACETIC ACID[0.0101337636]");
2383 CHECK(abs((t_calc / t) - 1) < 1e-3);
2384
2385 t = 372.774;
2386 t_calc = CoolProp::PropsSI("T", "P", 72915.92217342, "Q", 0, "PCSAFT::WATER[0.2691800943]&ACETIC ACID[0.7308199057]");
2387 CHECK(abs((t_calc / t) - 1) < 2e-3);
2388
2389 t = 298.15;
2390 t_calc = CoolProp::PropsSI("T", "P", 2387.42669687, "Q", 0, "PCSAFT::Na+[0.0907304774758426]&Cl-[0.0907304774758426]&WATER[0.818539045048315]");
2391 CHECK(abs((t_calc / t) - 1) < 1e-2);
2392}
2393
2394TEST_CASE("Github issue #2470", "[pureflash]") {
2395 auto fluide = "Nitrogen";
2396 auto enthalpy = 67040.57857; //J / kg
2397 auto pressure = 3368965.046; //Pa
2398 std::shared_ptr<CoolProp::AbstractState> AS(AbstractState::factory("HEOS", fluide));
2399 AS->update(PQ_INPUTS, pressure, 1);
2400 auto Ts = AS->T();
2401 AS->specify_phase(iphase_gas);
2402 CHECK_NOTHROW(AS->update(PT_INPUTS, pressure, Ts));
2403 AS->unspecify_phase();
2404 CHECK_NOTHROW(AS->update(HmassP_INPUTS, enthalpy, pressure));
2405 auto Tfinal = AS->T();
2406 CHECK(Tfinal > AS->T_critical());
2407}
2408
2409TEST_CASE("Github issue #2467", "[pureflash]") {
2410 auto fluide = "Pentane";
2411 std::shared_ptr<CoolProp::AbstractState> AS(AbstractState::factory("HEOS", fluide));
2412 AS->update(CoolProp::QT_INPUTS, 1, 353.15);
2413 double p1 = AS->p();
2414 AS->update(CoolProp::QT_INPUTS, 1, 433.15);
2415 double p2 = AS->p();
2416 AS->update(CoolProp::PT_INPUTS, p1, 393.15);
2417 double s1 = AS->smass();
2418 CHECK_NOTHROW(AS->update(CoolProp::PSmass_INPUTS, p2, s1));
2419}
2420
2421TEST_CASE("Github issue #1870", "[pureflash]") {
2422 auto fluide = "Pentane";
2423 std::shared_ptr<CoolProp::AbstractState> AS(AbstractState::factory("HEOS", fluide));
2424 CHECK_NOTHROW(AS->update(CoolProp::PSmass_INPUTS, 1000000, 1500));
2425}
2426
2427TEST_CASE("Github issue #2447", "[2447]") {
2428 double pvap = PropsSI("P", "T", 360 + 273.15, "Q", 0, "INCOMP::S800");
2429 double err = std::abs(pvap / 961e3 - 1);
2430 CHECK(err < 0.05);
2431}
2432
2433TEST_CASE("Github issue #2558", "[2558]") {
2434 double Tau = CoolProp::PropsSI("Tau", "Dmolar|gas", 200.0, "T", 300.0, "CarbonDioxide[0.5]&Hydrogen[0.5]");
2435 double Delta = CoolProp::PropsSI("Delta", "Dmolar|gas", 200.0, "T", 300.0, "CarbonDioxide[0.5]&Hydrogen[0.5]");
2436 CHECK(std::isfinite(Tau));
2437 CHECK(std::isfinite(Delta));
2438}
2439
2440TEST_CASE("Github issue #2491", "[2491]") {
2441 std::shared_ptr<CoolProp::AbstractState> AS(AbstractState::factory("HEOS", "Xenon"));
2442 CHECK_NOTHROW(AS->update(CoolProp::HmassP_INPUTS, 59867.351071950761, 5835843.7305891514));
2443 CHECK(std::isfinite(AS->rhomolar()));
2444}
2445
2446TEST_CASE("Github issue #2608", "[2608]") {
2447 std::shared_ptr<CoolProp::AbstractState> AS(AbstractState::factory("HEOS", "CO2"));
2448 double pc = AS->p_critical();
2449 CHECK_NOTHROW(AS->update(CoolProp::PT_INPUTS, 73.8e5, 218.048));
2450 SECTION("Without phase"){
2451 AS->unspecify_phase();
2452 CHECK_NOTHROW(AS->update(CoolProp::PSmass_INPUTS, 73.8e5, 1840.68));
2453 }
2454 SECTION("With phase"){
2455 AS->specify_phase(iphase_supercritical_gas);
2456 CHECK_NOTHROW(AS->update(CoolProp::PSmass_INPUTS, 73.8e5, 1840.68));
2457 AS->unspecify_phase();
2458 }
2459}
2460
2461template <typename T>
2462std::vector<T> linspace(T start, T end, int num) {
2463 std::vector<T> linspaced;
2464 if (num <= 0) {
2465 return linspaced; // Return empty vector for invalid num
2466 }
2467 if (num == 1) {
2468 linspaced.push_back(start);
2469 return linspaced;
2470 }
2471
2472 T step = (end - start) / (num - 1);
2473 for (int i = 0; i < num; ++i) {
2474 linspaced.push_back(start + step * i);
2475 }
2476 return linspaced;
2477}
2478
2479TEST_CASE("Github issue #2582", "[2582]") {
2480 std::shared_ptr<CoolProp::AbstractState> AS(AbstractState::factory("HEOS", "CO2"));
2481 double pc = AS->p_critical();
2482 AS->update(PQ_INPUTS, 73.33e5, 0);
2483 double hmass_liq = AS->saturated_liquid_keyed_output(iHmass);
2484 double hmass_vap = AS->saturated_vapor_keyed_output(iHmass);
2485// std::cout << pc << std::endl;
2486// std::cout << hmass_liq << std::endl;
2487// std::cout << hmass_vap << std::endl;
2488 for (auto hmass: linspace(100e3, 700e3, 1000)){
2489 CAPTURE(hmass);
2490 CHECK_NOTHROW(AS->update(CoolProp::HmassP_INPUTS, hmass, 73.76e5));
2491 }
2492 for (auto hmass: linspace(100e3, 700e3, 1000)){
2493 CAPTURE(hmass);
2494 CHECK_NOTHROW(AS->update(CoolProp::HmassP_INPUTS, hmass, 73.33e5));
2495 }
2496}
2497
2498TEST_CASE("Github issue #2594", "[2594]") {
2499 std::shared_ptr<CoolProp::AbstractState> AS(AbstractState::factory("HEOS", "CO2"));
2500 auto p = 7377262.928140703;
2501 double pc = AS->p_critical();
2502 AS->update(PQ_INPUTS, p, 0);
2503 double Tsat = AS->T();
2504 double rholiq = AS->rhomolar();
2505 double umass_liq = AS->saturated_liquid_keyed_output(iUmass);
2506 double umass_vap = AS->saturated_vapor_keyed_output(iUmass);
2507// std::cout << std::setprecision(20) << pc << std::endl;
2508// std::cout << umass_liq << std::endl;
2509// std::cout << umass_vap << std::endl;
2510
2511 auto umass = 314719.5306503257;
2512// auto& rHEOS = *dynamic_cast<HelmholtzEOSMixtureBackend*>(AS.get());
2513// bool sat_called = false;
2514// auto MM = AS->molar_mass();
2515// rHEOS.p_phase_determination_pure_or_pseudopure(iUmolar, umass*MM, sat_called);
2516// CHECK(rHEOS.phase() == iphase_liquid);
2517
2518 AS->update(DmolarP_INPUTS, rholiq, p);
2519 double rho1 = AS->rhomolar();
2520 double T1 = AS->T();
2521 double dumolardT_P = AS->first_partial_deriv(iUmolar, iT, iP);
2522 double dpdrho_T = AS->first_partial_deriv(iP, iDmolar, iT);
2523// double dumassdT_P = AS->first_partial_deriv(iUmass, iT, iP);
2524
2525 AS->specify_phase(iphase_liquid);
2526 AS->update(PT_INPUTS, p, Tsat);
2527 double rho2 = AS->rhomolar();
2528 double T2 = AS->T();
2529 double dpdrho_T_imposed = AS->first_partial_deriv(iP, iDmolar, iT);
2530 double dumolardT_P_imposed = AS->first_partial_deriv(iUmolar, iT, iP);
2531// double dumassdT_P_imposed = AS->first_partial_deriv(iUmass, iT, iP);
2532 AS->unspecify_phase();
2533
2534 CHECK_NOTHROW(AS->update(CoolProp::PUmass_INPUTS, p, umass));
2535
2536 BENCHMARK("dp/drho|T"){
2537 return AS->first_partial_deriv(iP, iDmolar, iT);
2538 };
2539 BENCHMARK("du/dT|p"){
2540 return AS->first_partial_deriv(iUmolar, iT, iP);
2541 };
2542}
2543
2544
2545TEST_CASE("CoolProp.jl tests", "[2598]") {
2546// // Whoah, actually quite a few change meaningfully
2547// SECTION("Check pcrit doesn't change too much with SA on"){
2548// auto init = get_config_bool(ENABLE_SUPERANCILLARIES);
2549// for (auto fluid : strsplit(get_global_param_string("fluids_list"), ',')){
2550// CAPTURE(fluid);
2551// set_config_bool(ENABLE_SUPERANCILLARIES, true); auto pcrit_SA = Props1SI(fluid, "pcrit");
2552// set_config_bool(ENABLE_SUPERANCILLARIES, false); auto pcrit_noSA = Props1SI(fluid, "pcrit");
2553// CAPTURE(pcrit_SA - pcrit_noSA);
2554// CHECK(std::abs(pcrit_SA/pcrit_noSA-1) < 1E-2);
2555// }
2556// set_config_bool(ENABLE_SUPERANCILLARIES, init);
2557// }
2558
2559 for (auto fluid : strsplit(get_global_param_string("fluids_list"), ',')){
2560 auto pcrit = Props1SI(fluid, "pcrit");
2561 auto Tcrit = Props1SI(fluid, "Tcrit");
2562 CAPTURE(fluid);
2563 CAPTURE(PhaseSI("P", pcrit+50000, "T", Tcrit+3, fluid));
2564 CAPTURE(PhaseSI("P", pcrit+50000, "T", Tcrit-3, fluid));
2565 CAPTURE(PhaseSI("P", pcrit-50000, "T", Tcrit+3, fluid));
2566
2567 CAPTURE(PropsSI("Q", "P", pcrit+50000, "T", Tcrit+3, fluid));
2568 CAPTURE(PropsSI("Q", "P", pcrit+50000, "T", Tcrit-3, fluid));
2569 CAPTURE(PropsSI("Q", "P", pcrit-50000, "T", Tcrit+3, fluid));
2570
2571 CHECK(PhaseSI("P", pcrit+50000, "T", Tcrit+3, fluid)=="supercritical");
2572 CHECK(PhaseSI("P", pcrit+50000, "T", Tcrit-3, fluid)=="supercritical_liquid");
2573 CHECK(PhaseSI("P", pcrit-50000, "T", Tcrit+3, fluid)=="supercritical_gas");
2574 }
2575}
2576
2577TEST_CASE("Check methanol EOS matches REFPROP 10", "[2538]"){
2578 auto TNBP_RP = PropsSI("T", "P", 101325, "Q", 0, "REFPROP::METHANOL");
2579 auto TNBP_CP = PropsSI("T", "P", 101325, "Q", 0, "HEOS::METHANOL");
2580 CHECK(TNBP_RP == Catch::Approx(TNBP_CP).epsilon(1e-6));
2581
2582 auto rhoL_RP = PropsSI("D", "T", 400, "Q", 0, "REFPROP::METHANOL");
2583 auto rhoL_CP = PropsSI("D", "T", 400, "Q", 0, "HEOS::METHANOL");
2584 CHECK(rhoL_RP == Catch::Approx(rhoL_CP).epsilon(1e-12));
2585
2586 auto cp0_RP = PropsSI("CP0MOLAR", "T", 400, "Dmolar", 1e-5, "REFPROP::METHANOL");
2587 auto cp0_CP = PropsSI("CP0MOLAR", "T", 400, "Dmolar", 1e-5, "HEOS::METHANOL");
2588 CHECK(cp0_RP == Catch::Approx(cp0_CP).epsilon(1e-4));
2589
2590}
2591
2592
2593TEST_CASE("Check phase determination for PC-SAFT backend", "[pcsaft_phase]") {
2594 double den = 9033.114209728405;
2595 double den_calc = CoolProp::PropsSI("Dmolar", "T", 320., "P", 101325., "PCSAFT::TOLUENE");
2596 CHECK(abs((den_calc / den) - 1) < 1e-2);
2597 double phase = CoolProp::PropsSI("Phase", "T", 320., "P", 101325., "PCSAFT::TOLUENE");
2598 CHECK(phase == get_phase_index("phase_liquid"));
2599
2600 den = 0.376013;
2601 den_calc = CoolProp::PropsSI("Dmolar", "T", 320., "P", 1000., "PCSAFT::TOLUENE");
2602 CHECK(abs((den_calc / den) - 1) < 1e-2);
2603 phase = CoolProp::PropsSI("Phase", "T", 320., "P", 1000., "PCSAFT::TOLUENE");
2604 CHECK(phase == get_phase_index("phase_gas"));
2605}
2606
2607TEST_CASE("Check that indexes for mixtures are assigned correctly, especially for the association term", "[pcsaft_indexes]")
2608{
2609 // The tests are performed by adding parameters for extra compounds that actually
2610 // are not present in the system and ensuring that the properties of the fluid do not change.
2611
2612 // Binary mixture: water-acetic acid
2613 // set binary interaction parameter, if not already set
2614 std::string CAS_water = get_fluid_param_string("WATER","CAS");
2615 std::string CAS_aacid = "64-19-7";
2616 try {
2617 get_mixture_binary_pair_pcsaft(CAS_water, CAS_aacid, "kij");
2618 }
2619 catch (...) {
2620 set_mixture_binary_pair_pcsaft(CAS_water, CAS_aacid, "kij", -0.127);
2621 }
2622
2623 double t = 413.5385;
2624 double rho = 15107.481234283325;
2625 double p = CoolProp::PropsSI("P", "T", t, "Dmolar", rho, "PCSAFT::ACETIC ACID"); // only parameters for acetic acid
2626 double p_extra = CoolProp::PropsSI("P", "T", t, "Dmolar", rho, "PCSAFT::ACETIC ACID[1.0]&WATER[0]"); // same composition, but with mixture parameters
2627 CHECK(abs((p_extra - p)/ p * 100) < 1e-1);
2628
2629 // Binary mixture: water-furfural
2630 t = 400; // K
2631 // p = 34914.37778265716; // Pa
2632 rho = 10657.129498214763;
2633 p = CoolProp::PropsSI("P", "T", t, "Dmolar", rho, "PCSAFT::FURFURAL"); // only parameters for furfural
2634 p_extra = CoolProp::PropsSI("P", "T", t, "Dmolar", rho, "PCSAFT::WATER[0]&FURFURAL[1.0]"); // same composition, but with mixture of components
2635 CHECK(abs((p_extra - p)/ p * 100) < 1e-1);
2636
2637 // Mixture: NaCl in water with random 4th component
2638 t = 298.15; // K
2639 // p = 3153.417688548272; // Pa
2640 rho = 55320.89616248148;
2641 p = CoolProp::PropsSI("P", "T", t, "Dmolar", rho, "PCSAFT::WATER"); // only parameters for water
2642 p_extra = CoolProp::PropsSI("P", "T", t, "Dmolar", rho, "PCSAFT::Na+[0]&Cl-[0]&WATER[1.0]&DIMETHOXYMETHANE[0]"); // same composition, but with mixture of components
2643 CHECK(abs((p_extra - p)/ p * 100) < 1e-1);
2644}
2645
2647class SuperAncillaryOnFixture{
2648private:
2649 const configuration_keys m_key = ENABLE_SUPERANCILLARIES;
2650 const bool initial_value;
2651public:
2652 SuperAncillaryOnFixture() : initial_value(CoolProp::get_config_bool(m_key)) {
2653 CoolProp::set_config_bool(m_key, true);
2654 }
2655 ~SuperAncillaryOnFixture(){
2656 CoolProp::set_config_bool(m_key, initial_value);
2657 }
2658};
2659
2661class SuperAncillaryOffFixture{
2662private:
2663 const configuration_keys m_key = ENABLE_SUPERANCILLARIES;
2664 const bool initial_value;
2665public:
2666 SuperAncillaryOffFixture() : initial_value(CoolProp::get_config_bool(m_key)) {
2667 CoolProp::set_config_bool(m_key, false);
2668 }
2669 ~SuperAncillaryOffFixture(){
2670 CoolProp::set_config_bool(m_key, initial_value);
2671 }
2672};
2673
2674
2675TEST_CASE_METHOD(SuperAncillaryOnFixture, "Check superancillary for water", "[superanc]") {
2676
2677 auto json = nlohmann::json::parse(get_fluid_param_string("WATER", "JSON"))[0].at("EOS")[0].at("SUPERANCILLARY");
2679 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "Water"));
2680 shared_ptr<CoolProp::AbstractState> IF97(CoolProp::AbstractState::factory("IF97", "Water"));
2681 auto& rHEOS = *dynamic_cast<HelmholtzEOSMixtureBackend*>(AS.get());
2682 BENCHMARK("HEOS.clear()"){
2683 return rHEOS.clear();
2684 };
2685 BENCHMARK("HEOS rho(T)"){
2686 return AS->update(QT_INPUTS, 1.0, 300.0);
2687 };
2688 BENCHMARK("HEOS update_QT_pure_superanc(Q,T)"){
2689 return rHEOS.update_QT_pure_superanc(1.0, 300.0);
2690 };
2691 BENCHMARK("superanc rho(T)"){
2692 return anc.eval_sat(300.0, 'D', 1);
2693 };
2694 BENCHMARK("IF97 rho(T)"){
2695 return IF97->update(QT_INPUTS, 1.0, 300.0);
2696 };
2697
2698 double Tmin = AS->get_fluid_parameter_double(0, "SUPERANC::Tmin");
2699 double Tc = AS->get_fluid_parameter_double(0, "SUPERANC::Tcrit_num");
2700 double pmin = AS->get_fluid_parameter_double(0, "SUPERANC::pmin");
2701 double pmax = AS->get_fluid_parameter_double(0, "SUPERANC::pmax");
2702
2703 CHECK_THROWS(AS->get_fluid_parameter_double(1, "SUPERANC::pmax"));
2704
2705 BENCHMARK("HEOS rho(p)"){
2706 return AS->update(PQ_INPUTS, 101325, 1.0);
2707 };
2708 BENCHMARK("superanc T(p)"){
2709 return anc.get_T_from_p(101325);
2710 };
2711 BENCHMARK("IF97 rho(p)"){
2712 return IF97->update(PQ_INPUTS, 101325, 1.0);
2713 };
2714}
2715
2716TEST_CASE_METHOD(SuperAncillaryOnFixture, "Benchmark class construction", "[superanc]") {
2717
2718 BENCHMARK("Water [SA]"){
2719 return shared_ptr<CoolProp::AbstractState>(CoolProp::AbstractState::factory("HEOS", "Water"));
2720 };
2721 BENCHMARK("R410A [no SA]"){
2722 return shared_ptr<CoolProp::AbstractState>(CoolProp::AbstractState::factory("HEOS", "R410A"));
2723 };
2724 BENCHMARK("propane [SA]"){
2725 return shared_ptr<CoolProp::AbstractState>(CoolProp::AbstractState::factory("HEOS", "n-Propane"));
2726 };
2727 BENCHMARK("air, pseudo-pure [SA]"){
2728 return shared_ptr<CoolProp::AbstractState>(CoolProp::AbstractState::factory("HEOS", "Air"));
2729 };
2730}
2731
2732TEST_CASE_METHOD(SuperAncillaryOffFixture, "Check superancillary-like calculations with superancillary disabled for water", "[superanc]") {
2733
2734 auto json = nlohmann::json::parse(get_fluid_param_string("WATER", "JSON"))[0].at("EOS")[0].at("SUPERANCILLARY");
2736 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "Water"));
2737 shared_ptr<CoolProp::AbstractState> IF97(CoolProp::AbstractState::factory("IF97", "Water"));
2738 auto& approxrhoL = anc.get_approx1d('D', 0);
2739
2740 BENCHMARK("HEOS rho(T)"){
2741 return AS->update(QT_INPUTS, 1.0, 300.0);
2742 };
2743 BENCHMARK("superanc rho(T)"){
2744 return anc.eval_sat(300.0, 'D', 1);
2745 };
2746 BENCHMARK("superanc rho(T) with expansion directly"){
2747 return approxrhoL.eval(300.0);
2748 };
2749 BENCHMARK("superanc get_index rho(T)"){
2750 return approxrhoL.get_index(300.0);
2751 };
2752 BENCHMARK("IF97 rho(T)"){
2753 return IF97->update(QT_INPUTS, 1.0, 300.0);
2754 };
2755
2756 BENCHMARK("HEOS rho(p)"){
2757 return AS->update(PQ_INPUTS, 101325, 1.0);
2758 };
2759 BENCHMARK("superanc T(p)"){
2760 return anc.get_T_from_p(101325);
2761 };
2762 BENCHMARK("IF97 rho(p)"){
2763 return IF97->update(PQ_INPUTS, 101325, 1.0);
2764 };
2765}
2766
2767
2768TEST_CASE_METHOD(SuperAncillaryOnFixture, "Check superancillary functions are available for all pure fluids", "[ancillary]") {
2769 for (auto & fluid : strsplit(CoolProp::get_global_param_string("fluids_list"), ',')){
2770 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", fluid));
2771 auto& rHEOS = *dynamic_cast<HelmholtzEOSMixtureBackend*>(AS.get());
2772 if (rHEOS.is_pure()){
2773 CAPTURE(fluid);
2774 CHECK_NOTHROW(rHEOS.update_QT_pure_superanc(1, rHEOS.T_critical()*0.9999));
2775 }
2776 }
2777};
2778
2779TEST_CASE_METHOD(SuperAncillaryOnFixture, "Check out of bound for superancillary", "[superanc]") {
2780 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "Water"));
2781 CHECK_THROWS(AS->update(PQ_INPUTS, 100000000001325, 1.0));
2782 CHECK_THROWS(AS->update(QT_INPUTS, 1.0, 1000000));
2783}
2784
2785TEST_CASE_METHOD(SuperAncillaryOnFixture, "Check throws for R410A", "[superanc]") {
2786 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "R410A"));
2787 auto& rHEOS = *dynamic_cast<HelmholtzEOSMixtureBackend*>(AS.get());
2788 CHECK_THROWS(rHEOS.update_QT_pure_superanc(1.0, 300.0));
2789}
2790
2791TEST_CASE_METHOD(SuperAncillaryOnFixture, "Check throws for REFPROP", "[superanc]") {
2792 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("REFPROP", "WATER"));
2793 CHECK_THROWS(AS->update_QT_pure_superanc(1.0, 300.0));
2794}
2795
2796TEST_CASE_METHOD(SuperAncillaryOnFixture, "Check Tc & pc", "[superanccrit]") {
2797 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "Water"));
2798 set_config_bool(ENABLE_SUPERANCILLARIES, true);
2799 auto TcSA = AS->T_critical();
2800 auto pcSA = AS->p_critical();
2801 auto rhocSA = AS->rhomolar_critical();
2802 set_config_bool(ENABLE_SUPERANCILLARIES, false);
2803 auto TcnonSA = AS->T_critical();
2804 auto pcnonSA = AS->p_critical();
2805 auto rhocnonSA = AS->rhomolar_critical();
2806 CHECK(TcSA != TcnonSA);
2807 CHECK(pcSA != pcnonSA);
2808 CHECK(rhocSA != rhocnonSA);
2809}
2810
2811TEST_CASE_METHOD(SuperAncillaryOnFixture, "Check h_fg", "[superanc]") {
2812 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "Water"));
2813 CHECK_THROWS(AS->saturated_vapor_keyed_output(iHmolar) - AS->saturated_liquid_keyed_output(iHmolar));
2814 AS->update_QT_pure_superanc(1, 300);
2815 CHECK_NOTHROW(AS->saturated_vapor_keyed_output(iHmolar) - AS->saturated_liquid_keyed_output(iHmolar));
2816}
2817
2818TEST_CASE_METHOD(SuperAncillaryOnFixture, "Performance regression; on", "[2438]") {
2819 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "CO2"));
2820 BENCHMARK("HP regression"){
2821 AS->update(HmassP_INPUTS, 300e3, 70e5);
2822 return AS;
2823 };
2824 AS->update(HmassP_INPUTS, 300e3, 70e5);
2825 std::cout << AS->Q() << std::endl;
2826}
2827TEST_CASE_METHOD(SuperAncillaryOffFixture, "Performance regression; off", "[2438]") {
2828 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "CO2"));
2829 BENCHMARK("HP regression"){
2830 AS->update(HmassP_INPUTS, 300e3, 70e5);
2831 return AS;
2832 };
2833 AS->update(HmassP_INPUTS, 300e3, 70e5);
2834 std::cout << AS->Q() << std::endl;
2835}
2836
2837TEST_CASE_METHOD(SuperAncillaryOnFixture, "Performance regression for TS; on", "[2438]") {
2838 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "CO2"));
2839 double T = 298.0;
2840 AS->update(QT_INPUTS, 1, T);
2841 auto sL = AS->saturated_liquid_keyed_output(iSmolar);
2842 auto sV = AS->saturated_vapor_keyed_output(iSmolar);
2843 BENCHMARK("ST regression"){
2844 AS->update(SmolarT_INPUTS, (sL + sV)/2, T);
2845 return AS;
2846 };
2847}
2848
2849TEST_CASE_METHOD(SuperAncillaryOffFixture, "Performance regression for TS; off", "[2438]") {
2850 shared_ptr<CoolProp::AbstractState> AS(CoolProp::AbstractState::factory("HEOS", "CO2"));
2851 double T = 298.0;
2852 AS->update(QT_INPUTS, 1, T);
2853 auto sL = AS->saturated_liquid_keyed_output(iSmolar);
2854 auto sV = AS->saturated_vapor_keyed_output(iSmolar);
2855 BENCHMARK("ST regression"){
2856 AS->update(SmolarT_INPUTS, (sL + sV)/2, T);
2857 return AS;
2858 };
2859}
2860
2861TEST_CASE_METHOD(SuperAncillaryOnFixture, "Benchmarking caching options", "[caching]") {
2862 std::array<double, 16> buf15; buf15.fill(0.0);
2863 std::array<double, 100> buf100; buf100.fill(0.0);
2864 std::array<bool, 100> bool100; bool100.fill(false);
2865 std::vector<CachedElement> cache100(100);
2866 for (auto i = 0; i < cache100.size(); ++i){ cache100[i] = _HUGE; }
2867
2868 std::vector<std::optional<double>> opt100(100);
2869 for (auto i = 0; i < opt100.size(); ++i){ opt100[i] = _HUGE; }
2870
2871 BENCHMARK("memset array15 w/ 0"){
2872 std::memset(buf15.data(), 0, sizeof(buf15));
2873 return buf15;
2874 };
2875 BENCHMARK("std::fill_n array15"){
2876 std::fill_n(buf15.data(), 15, _HUGE);
2877 return buf15;
2878 };
2879 BENCHMARK("std::fill array15"){
2880 std::fill(buf15.begin(), buf15.end(), _HUGE);
2881 return buf15;
2882 };
2883 BENCHMARK("array15.fill()"){
2884 buf15.fill(_HUGE);
2885 return buf15;
2886 };
2887 BENCHMARK("memset array100 w/ 0"){
2888 memset(buf100.data(), 0, sizeof(buf100));
2889 return buf100;
2890 };
2891 BENCHMARK("memset bool100 w/ 0"){
2892 memset(bool100.data(), false, sizeof(bool100));
2893 return buf100;
2894 };
2895 BENCHMARK("std::fill_n array100"){
2896 std::fill_n(buf100.data(), 100, _HUGE);
2897 return buf100;
2898 };
2899 BENCHMARK("fill array100"){
2900 buf100.fill(_HUGE);
2901 return buf100;
2902 };
2903 BENCHMARK("fill cache100"){
2904 for (auto i = 0; i < cache100.size(); ++i){ cache100[i] = _HUGE; }
2905 return cache100;
2906 };
2907 BENCHMARK("fill opt100"){
2908 for (auto i = 0; i < opt100.size(); ++i){ opt100[i] = _HUGE; }
2909 return opt100;
2910 };
2911}
2912
2913/*
2914TEST_CASE("Test that HS solver works for a few fluids", "[HS_solver]")
2915{
2916 std::vector<std::string> fluids; fluids.push_back("Propane"); fluids.push_back("D4"); fluids.push_back("Water");
2917 for (std::size_t i = 0; i < fluids.size(); ++i)
2918 {
2919 std::vector<std::string> fl(1,fluids[i]);
2920 shared_ptr<CoolProp::HelmholtzEOSMixtureBackend> HEOS(new CoolProp::HelmholtzEOSMixtureBackend(fl));
2921 for (double p = HEOS->p_triple()*10; p < HEOS->pmax(); p *= 10)
2922 {
2923 double Tmin = HEOS->Ttriple();
2924 double Tmax = HEOS->Tmax();
2925 for (double T = Tmin + 1; T < Tmax-1; T += 10)
2926 {
2927 std::ostringstream ss;
2928 ss << "Check HS for " << fluids[i] << " for T=" << T << ", p=" << p;
2929 SECTION(ss.str(),"")
2930 {
2931 CHECK_NOTHROW(HEOS->update(PT_INPUTS, p, T));
2932 std::ostringstream ss1;
2933 ss1 << "h=" << HEOS->hmolar() << ", s=" << HEOS->smolar();
2934 SECTION(ss1.str(),"")
2935 {
2936 CAPTURE(T);
2937 CAPTURE(p);
2938 CAPTURE(HEOS->hmolar());
2939 CAPTURE(HEOS->smolar());
2940 CHECK_NOTHROW(HEOS->update(HmolarSmolar_INPUTS, HEOS->hmolar(), HEOS->smolar()));
2941 double Terr = HEOS->T()- T;
2942 CAPTURE(Terr);
2943 CHECK(std::abs(Terr) < 1e-6);
2944 }
2945 }
2946 }
2947 }
2948 }
2949}
2950*/
2951#endif