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]Z]Y/fZY{
Z
{ZfY{Z{Y{|/m
Z{Y{|m
Methane
Ethane
Propane
(MW=16.043)
(MW=30.07)
(MW=44.1)
Tc = 190.56 k
Tc = 305.32 k
Tc = 369.83 k
Pc = 4.599 Mpa
Pc = 4.872 Mpa
Pc = 4.248 Mpa
= 0.011
= 0.099
= 0.152
# 48
# 49
# 46
T (K)
B (cm3/mol)
110.83
112.43
114.45
116.79
121.25
128.84
136.75
148.28
155.89
160
162.29
167.67
178.41
180
181.86
186
189
190.55
192.64
193
196
200
202.49
207
220
-330.1
-319.9
-307.8
-295.5
-274.5
-244.3
-218.9
-187.7
-167.95
-160.37
-158.4
-146.55
-132.2
-128.61
-125.7
-120.61
-116.93
-115.08
-112.85
-112.26
-108.91
-104.66
-103.4
-97.71
-86.3
*
t
t
*
*
*
*
*
t
*
*
t
*
t
*
*
*
T (K)
B (cm3/mol)
191.86
200
210.8
215
225
231.4
240
250
254.81
259.87
269.19
273.15
275
280.45
290
293.2
298.15
300
303.15
306.06
310
313.2
320
323.1
323.15
-498
-419.2
-374
-340.6
-328.4
-313
-276.5
-264.9
-252.3
-240.2
-214
-219
-218
-206.8
-195.7
-190.9
-185.8
-182.7
-178.9
-175.3
-168.9
-168.4
-159.3
-156.1
-156.7
i
*
*
*
*
t
*
*
*
*
*
t
*
*
*
*
t
*
*
t
T (K)
B (cm3/mol)
211.3
231.2
251.5
259.8
273.8
288.2
293.15
296
299.19
300
303.2
306.5
310.11
313.2
322.8
327.6
332.9
343.15
348.15
353.15
358.15
365.15
367.15
369.85
373.15
-844
-680
-567
-538.2
-471
-428.4
-406.8
-404.2
-403
-384.5
-383.5
-369
-357.1
-361.4
-338.2
-324
-309
-287.8
-279
-271
-263.1
-252.5
-250.2
-246.2
-241
*
*
*
t
*
*
*
t
*
t
*
*
*
t
*
*
*
t
*
*
225
240
250
260
273
275
285.65
300
320
325
350
375
398.15
423.15
473.15
498.23
523.15
548.15
573.15
598.15
623.15
648.31
673.31
-82.2
-71.6
-65.4
-59.98
-53.41
-52.4
-47.58
-42.23
-35.32
-33.4
-26.4
-20.4
-15.87
-11.4
-4.16
-1.31
1.49
3.89
5.98
7.88
9.66
11.25
12.75
*
*
*
t
*
*
*
*
t
*
*
t
*
*
*
*
*
*
*
*
*
325
330.17
333.2
343.15
345.03
348.15
350
356.2
360.94
365.46
372.52
383.15
394.2
413.15
423.15
448.15
453.6
473.15
498.15
523.15
548.15
573.15
598.15
623.15
-153.8
-148.7
-146.1
-135.3
-132
-133
-130.8
-128.8
-125
-117
-114.1
-105.3
-98.7
-88.1
-83.1
-72
-69.1
-61.8
-52.4
-43.5
-36.3
-30.9
-25
-19.6
Y{Y
ii
*
*
t
*
*
t
*
*
*
*
t
*
*
*
t
*
*
*
*
388.5
393.19
398.15
400.1
407.43
412.9
422.97
423.15
433.1
448.15
453.5
473
473.15
474.9
493.3
498.15
523.15
548.15
573.15
598.15
623.15
-213
-212
-208.9
-201
-196.9
-182
-179.9
-181.4
-172.6
-158.4
-156.2
-149.4
-138.5
-140
-128.1
-121.3
-109
-96
-81.3
-70.7
-61
*
t
*
*
*
t
*
*
*
*
t
*
*
*
*
*
*
Z{Y{|mY{Y
Butane
Pentane
Hexane
(MW=58.122)
(MW=72.15)
(MW=86.175)
Tc = 425.12 k
Tc = 469.7 k
Tc = 507.6 k
Pc = 3.796 Mpa
Pc = 3.370 Mpa
Pc = 3.025 Mpa
= 0.200
= 0.252
= 0.300
# 46
# 39
# 47
T (K)
B (cm3/mol)
273.06
280
290
296.1
297.14
300
303.15
309.5
310
318.15
320
323.15
325
328.15
334.6
338.15
344.26
348.15
350
353.1
360.93
368.25
373.29
375
377.59
378.18
393.8
-897
-817.6
-752.6
-743
-735
-695.9
-686.6
-661
-646
-632.5
-601.8
-588.7
-586.8
-581.2
-555.7
-539.3
-517
-502.3
-494.5
-489.2
-464.7
-444.2
-429.5
-426.5
-418.6
-418
-385.9
*
*
*
t
*
t
*
t
*
*
*
t
*
*
*
t
*
*
T (K)
B (cm3/mol)
270
280
290
300
308.15
310
318.15
328.15
330
338.15
339
348.15
351.2
353
368.15
373.15
378.9
383.7
388.4
398.15
401
413.15
413.6
423.15
427.15
448.15
453.15
-1513
-1378
-1261
-1159
-1068
-1069
-981
-917
-919
-864
-863
-820
-783
-747
-715
-680
-652
-623
-612
-592
-578
-535
-517
-522
-500
-452
-445
iii
*
*
*
*
t
*
*
t
*
*
t
*
*
t
*
t
*
*
t
*
*
t
*
*
*
*
T (K)
B (cm3/mol)
308.15
313.5
315.15
318
318.2
323.15
323.2
324
328
329
333.2
337.7
338.5
339.4
342.4
347.3
348
348.2
348.25
354
358.5
363.2
370.6
373.35
377.7
386.7
393.15
-1670
-1676
-1750
-1598
-1580
-1590
-1606
-1496
-1490
-1419
-1380
-1338
-1326
-1310
-1289
-1239
-1235
-1230
-1232
-1194
-1144
-1100
-1050
-1020
-992
-928
-862
*
*
t
*
*
t
*
*
t
*
*
t
*
t
*
*
t
*
*
394.26
398.15
400
410.93
413
423.14
425
433.3
444.26
448.18
450
472.8
498
498.81
498.98
537.16
573.2
579.46
580.48
-381.3
-376
-369
-348.6
-345.9
-326.1
-321.5
-314.3
-289.8
-284.8
-281.5
-253.3
-220.3
-213.9
-201.4
-167.1
-157.4
-125.9
-124.6
*
*
t
t
*
*
*
*
*
*
*
*
*
*
*
*
*
469.65
473.15
498.15
523.15
523.16
548.15
548.16
573.15
573.16
598.15
623.15
648.15
-403
-400
-356
-310
-311
-273
-271
-240
-236
-213
-192
-174
*
*
*
*
t
*
*
*
*
*
*
*
403.15
410.1
413.1
422.49
426.15
433.2
446.98
453.12
463.2
473.15
493.15
498.54
507.95
523.15
548.84
573.15
574.65
599.82
623.15
663.15
-850
-800
-771
-758
-752
-677
-661
-615
-613
-555
-524
-506
-469
-449
-396
-354
-350
-309
-293
-214
*
*
*
t
*
*
*
*
*
t
*
*
*
*
*
*
*
*
*
1
2
3
4
Critical Temperature
Critical Pressure
Molcular Weight
Acentric Factor
iv
]Z]Y/fZY{
{Z
\fY/Y/{|fZ]
Z{\ze{
% **************************************************************************
% Estimation Of Second Virial Coefficients By Using Neural Network (NN)
% By Kourosh Esfandiari
% Babol University of Technology
% Faculty Of Chemical Engineering
% ***********************************************************************************
clear all ;
clc ;
% ***********************************************************************************
c1=[190.56 190.56 190.56 190.56 190.56 190.56 190.56 190.56 190.56 190.56 190.56
190.56 190.56 190.56 190.56 190.56 190.56 190.56 190.56 190.56 190.56 190.56
190.56 190.56 190.56 190.56 190.56 190.56 190.56 190.56 ; ...
4.5990 4.5990 4.5990 4.5990 4.5990 4.5990 4.5990 4.5990 4.5990 4.5990 4.5990
4.5990 4.5990 4.5990 4.5990 4.5990 4.5990 4.5990 4.5990 4.5990 4.5990 4.5990
4.5990 4.5990 4.5990 4.5990 4.5990 4.5990 4.5990 4.5990 ; ...
16.056 16.056 16.056 16.056 16.056 16.056 16.056 16.056 16.056 16.056 16.056
16.056 16.056 16.056 16.056 16.056 16.056 16.056 16.056 16.056 16.056 16.056
16.056 16.056 16.056 16.056 16.056 16.056 16.056 16.056 ; ...
0.0110 0.0110 0.0110 0.0110 0.0110 0.0110 0.0110 0.0110 0.0110 0.0110 0.0110
0.0110 0.0110 0.0110 0.0110 0.0110 0.0110 0.0110 0.0110 0.0110 0.0110 0.0110
0.0110 0.0110 0.0110 0.0110 0.0110 0.0110 0.0110 0.0110 ; ...
110.83 121.25 136.75 148.28 155.89 160.00 178.41 180.00 190.55 200.00 207.00
220.00 240.00 250.00 260.00 275.00 285.65 300.00 320.00 350.00 375.00 423.15
473.15 498.23 523.15 548.15 573.15 598.15 623.15 673.31 ] ;
c2=[305.32 305.32 305.32 305.32 305.32 305.32 305.32 305.32 305.32 305.32 305.32
305.32 305.32 305.32 305.32 305.32 305.32 305.32 305.32 305.32 305.32 305.32
305.32 305.32 305.32 305.32 305.32 305.32 305.32 305.32 ; ...
4.8720 4.8720 4.8720 4.8720 4.8720 4.8720 4.8720 4.8720 4.8720 4.8720 4.8720
4.8720 4.8720 4.8720 4.8720 4.8720 4.8720 4.8720 4.8720 4.8720 4.8720 4.8720
4.8720 4.8720 4.8720 4.8720 4.8720 4.8720 4.8720 4.8720 ; ...
30.070 30.070 30.070 30.070 30.070 30.070 30.070 30.070 30.070 30.070 30.070
30.070 30.070 30.070 30.070 30.070 30.070 30.070 30.070 30.070 30.070 30.070
30.070 30.070 30.070 30.070 30.070 30.070 30.070 30.070 ; ...
0.0990 0.0990 0.0990 0.0990 0.0990 0.0990 0.0990 0.0990 0.0990 0.0990 0.0990
0.0990 0.0990 0.0990 0.0990 0.0990 0.0990 0.0990 0.0990 0.0990 0.0990 0.0990
0.0990 0.0990 0.0990 0.0990 0.0990 0.0990 0.0990 0.0990 ; ...
191.86 200.00 210.00 215.00 231.40 240.00 250.00 259.87 269.19 275.00 280.45
290.00 300.00 310.00 320.00 330.17 343.15 350.00 360.94 372.52 383.15 394.20
413.15 448.15 473.15 498.15 548.15 573.15 598.15 623.15 ] ;
c3=[369.83 369.83 369.83 369.83 369.83 369.83 369.83 369.83 369.83 369.83 369.83
369.83 369.83 369.83 369.83 369.83 369.83 369.83 369.83 369.83 369.83 369.83
369.83 369.83 369.83 369.83 369.83 369.83 369.83 369.83 ; ...
4.2480 4.2480 4.2480 4.2480 4.2480 4.2480 4.2480 4.2480 4.2480 4.2480 4.2480
4.2480 4.2480 4.2480 4.2480 4.2480 4.2480 4.2480 4.2480 4.2480 4.2480 4.2480
4.2480 4.2480 4.2480 4.2480 4.2480 4.2480 4.2480 4.2480 ; ...
44.100 44.100 44.100 44.100 44.100 44.100 44.100 44.100 44.100 44.100 44.100
44.100 44.100 44.100 44.100 44.100 44.100 44.100 44.100 44.100 44.100 44.100
44.100 44.100 44.100 44.100 44.100 44.100 44.100 44.100 ; ...
0.1520 0.1520 0.1520 0.1520 0.1520 0.1520 0.1520 0.1520 0.1520 0.1520 0.1520
ii
0.1520 0.1520 0.1520 0.1520 0.1520 0.1520 0.1520 0.1520 0.1520 0.1520 0.1520
0.1520 0.1520 0.1520 0.1520 0.1520 0.1520 0.1520 0.1520 ; ...
211.30 231.20 251.50 273.80 288.20 293.15 300.00 310.11 322.80 332.90 343.15
353.15 358.15 365.15 369.85 373.15 388.50 400.10 412.90 422.97 433.10 448.15
453.50 474.90 498.15 523.15 548.15 573.15 598.15 623.15 ] ;
c4=[425.12 425.12 425.12 425.12 425.12 425.12 425.12 425.12 425.12 425.12 425.12
425.12 425.12 425.12 425.12 425.12 425.12 425.12 425.12 425.12 425.12 425.12
425.12 425.12 425.12 425.12 425.12 425.12 425.12 425.12 ; ...
3.7960 3.7960 3.7960 3.7960 3.7960 3.7960 3.7960 3.7960 3.7960 3.7960 3.7960
3.7960 3.7960 3.7960 3.7960 3.7960 3.7960 3.7960 3.7960 3.7960 3.7960 3.7960
3.7960 3.7960 3.7960 3.7960 3.7960 3.7960 3.79600 3.760 ; ...
58.122 58.122 58.122 58.122 58.122 58.122 58.122 58.122 58.122 58.122 58.122
58.122 58.122 58.122 58.122 58.122 58.122 58.122 58.122 58.122 58.122 58.122
58.122 58.122 58.122 58.122 58.122 58.122 58.122 58.122 ; ...
0.2000 0.2000 0.2000 0.2000 0.2000 0.2000 0.2000 0.2000 0.2000 0.2000 0.2000
0.2000 0.2000 0.2000 0.2000 0.2000 0.2000 0.2000 0.2000 0.2000 0.2000 0.2000
0.2000 0.2000 0.2000 0.2000 0.2000 0.2000 0.2000 0.2000 ; ...
273.06 280.00 290.00 300.00 310.00 320.00 328.15 338.15 348.15 350.00 360.93
373.29 375.00 378.18 393.80 400.00 410.93 425.00 433.30 444.26 448.18 450.00
472.80 498.00 498.81 498.98 537.16 573.20 579.46 580.48 ] ;
c5=[469.70 469.70 469.70 469.70 469.70 469.70 469.70 469.70 469.70 469.70 469.70
469.70 469.70 469.70 469.70 469.70 469.70 469.70 469.70 469.70 469.70 469.70
469.70 469.70 469.70 469.70 469.70 469.70 469.70 469.70 ; ...
3.3700 3.3700 3.3700 3.3700 3.3700 3.3700 3.3700 3.3700 3.3700 3.3700 3.3700
3.3700 3.3700 3.3700 3.3700 3.3700 3.3700 3.3700 3.3700 3.3700 3.3700 3.3700
iii
c6=[507.60 507.60 507.60 507.60 507.60 507.60 507.60 507.60 507.60 507.60 507.60
507.60 507.60 507.60 507.60 507.60 507.60 507.60 507.60 507.60 507.60 507.60
507.60 507.60 507.60 507.60 507.60 507.60 507.60 507.60 ; ...
3.0250 3.0250 3.0250 3.0250 3.0250 3.0250 3.0250 3.0250 3.0250 3.0250 3.0250
3.0250 3.0250 3.0250 3.0250 3.0250 3.0250 3.0250 3.0250 3.0250 3.0250 3.0250
3.0250 3.0250 3.0250 3.0250 3.0250 3.0250 3.0250 3.0250 ; ...
86.175 86.175 86.175 86.175 86.175 86.175 86.175 86.175 86.175 86.175 86.175
86.175 86.175 86.175 86.175 86.175 86.175 86.175 86.175 86.175 86.175 86.175
86.175 86.175 86.175 86.175 86.175 86.175 86.175 86.175 ; ...
0.3000 0.3000 0.3000 0.3000 0.3000 0.3000 0.3000 0.3000 0.3000 0.3000 0.3000
0.3000 0.3000 0.3000 0.3000 0.3000 0.3000 0.3000 0.3000 0.3000 0.3000 0.3000
0.3000 0.3000 0.3000 0.3000 0.3000 0.3000 0.3000 0.3000 ; ...
308.15 315.15 323.15 324.00 333.20 337.70 339.40 347.30 354.00 363.20 373.35
386.70 393.15 403.15 410.10 422.49 433.20 446.98 453.12 463.20 473.15 498.54
507.95 523.15 548.84 573.15 574.65 599.82 623.15 663.15 ] ;
iv
%***********************************************************************************
b1=[-330.10 -274.50 -218.90 -187.70 -167.95 -160.37 -132.20 -128.61 -115.08 -104.66
-97.710 -86.030 -71.600 -65.400 -59.980 -52.400 -47.580 -42.230 -35.320 -26.400
-20.400 -11.400 -4.1600 -1.3100 1.4900 3.8900 5.9800 7.8800 9.6600 12.750
];
b2=[-498.00 -419.20 -374.00 -340.60 -313.00 -276.50 -264.90 -240.20 -214.00 -218.00
-206.80 -195.70 -182.70 -168.90 -159.30 -148.70 -135.30 -130.80 -125.00 -114.10
-105.30 -98.700 -88.100 -72.000 -61.800 -52.400 -36.300 -30.900 -25.000 -19.600
];
b3=[-844.00 -680.00 -567.00 -471.00 -428.40 -406.80 -384.50 -357.10 -338.20 -309.00
-287.80 -271.00 -263.10 -252.50 -246.20 -241.00 -213.00 -201.00 -182.00 -179.00
-172.60 -158.40 -156.20 -140.00 -121.30 -109.00 -96.000 -81.300 -70.700 -61.000
];
b4=[-897.00 -817.60 -752.60 -695.90 -646.00 -601.80 -581.20 -539.30 -502.30 -494.50
-464.70 -429.50 -426.50 -418.00 -385.90 -369.00 -348.60 -321.50 -314.30 -289.80
-284.80 -281.50 -253.30 -220.30 -213.90 -201.40 -167.10 -157.40 -125.90 -124.60
];
b5=[-1513.0 -1378.0 -1261.0 -1159.0 -1069.0 -981.00 -919.00 -864.00 -820.00 -783.00
-715.00 -652.00 -612.00 -578.00 -535.00 -522.00 -500.00 -452.00 -445.00 -403.00
-400.00 -356.00 -310.00 -273.00 -271.00 -240.00 -236.00 -213.00 - 192.00 -174.00
];
b6=[-1670.0 -1750.0 -1590.0 -1496.0 -1380.0 -1338.0 -1310.0 -1239.0 -1194.0 -1100.0
-1020.0 -928.00 -862.00 -850.00 -800.00 -758.00 -677.00 -661.00 -615.00 -613.00
-555.00 -506.00 -469.00 -449.00 -396.00 -354.00 -350.00 -309.00 -293.00 -214.00
];
% ***********************************************************************************
v
vi
vii
]Zd/
1 ] Demuth , Howard ; Mark Beale , Neural Network Toolbox User`s Guide , ( Math
Works Inc. , Natick , MA , USA , 200 )
2 ] Dymond , J.H ; K.N.Marsh ; R.C. Wilhoit ; K.C. Wong , Virial Coefficients of Pure
Gases and Mixtures , Subvolume A , ( Secretary of Commerce On Behalt of the U.S.
Government , 2002 )
4 ] Lide , David R. , CRC Handbook of Chemistry and Physics , ( CRC Press LLC ,
2007 )
,^YfZY{cYZfY,Y|m^Z^Z^,Z]|v,kZ
d^{Y,/^Z^rzZe,v|,/ZZe|v
ZZZa, ZMZe{zZZ{\^Zv ,{Z,/Z]Z]
Y/eZY{|Y{,|Y/ZZ
|Znu\z[Z^uZ{Md{]Y]{m]Y],Z,Y/
YYZzY]//^^|{Y||m]Y{Md{]d
Y|ZZY{||Y{,|YZZZZZa,
|Y,Z,^ZZ,^Z^cZ,{/,|
ii
BY
KOUROSH ESFANDIARI
THESIS
FOR THE DEGREE OF BACHELOR OF SCIENCE (B.Sc.)
September 2009