Volumetric Property Improvement for the Soave-Redlich-Kwong Equation of

State
Hong Lin, Yuan-Yuan Duan,* Tao Zhang, and Zhi-Min Huang
Key Laboratory for Thermal Science and Power Engineering of Ministry of Education, Tsinghua UniVersity,
Beijing 100084, Peoples Republic of China
This work presents a temperature-dependent volume translation to improve the volume properties of the Soave-
Redlich-Kwong equation of state (SRK EOS) for pure fluids and mixtures. The volume translation is
generalized as a function of the critical parameters and reduced temperature. The SRK EOS with the generalized
volume translation can accurately represent the densities for different polar and nonpolar fluids in the saturated
and supercritical region, including alkanes, olefins, alkines, cycloolefins, aromatics, alcohols, ethers, ketones,
halogenated hydrocarbons, and inorganic molecules. The average relative deviation is 1.73% for pure fluids
in the saturated region. The generalized volume translation SRK EOS (VTSRK EOS) has better accuracy
than other methods and EOSs in the saturated and supercritical regions.
Introduction
The Soave-Redlich-Kwong (SRK) equation of state (EOS)
1
is one of the van der Waals-type cubic EOSs that have been
widely used in the chemical industry. However, the predicted
constant critical compressibility factor for all fluids and the
prediction error for the saturated liquid density are two inherent
limitations of these EOSs. A volume translation method was
proposed by Martin
2
and Peneloux et al.
3
for the cubic EOS to
improve the SRK EOS for representing the critical compress-
ibility factor and the saturated liquid density. Peneloux and
Rauzy
3
used a linear volume translation term in the SRK EOS
to improve the saturated and high-pressure liquid densities for
nonpolar and polar fluids. The volume translation was correlated
as a function of the Rackett compressibility factor and the critical
parameters. Watson et al.
4
used volume translation to develop
the van der Waals-711 EOS for alkanes (nC1-nC16) with the
volume translation correlated with the critical parameters, the
acentric factor, and the reduced temperature. Yu and Lu
5
used
the volume translation technique with the Peng-Robinson (PR)
EOS and generalized the parameters in terms of the acentric
factor. Jhaverl and Youngren
6
used the volume translation
concept with the PR EOS to improve volumetric predictions of
reservoir fluids with the constant translation correlated as a
function of molecular weight. Carrier et al.
7
used group theory
to calculate the volume translation parameters with the PR EOS
for representing vapor pressure data in petroleum fluids. Chou
and Prausnitz
8
applied volume translation to the SRK EOS to
represent phase equilibrium and the densities of some pure fluids
in the vapor-liquid critical region. Magoulas and Tassios
9
developed a translated form of the van der Waals (t-vdW) and
the Peng-Robinson (t-PR) EOS for predicting vapor pressures,
saturated liquid volumes, and enthalpies of vaporization for
alkanes. Soave et al.
10
used a simple group-contribution method
to estimate the volume translation parameter in a new volume
translation RK EOS. Kenney et al.
11
used a hard-sphere volume
translation method in the van der Waals EOS to model
supercritical water oxidation. Ji and Lempe
12,13
applied tem-
perature-dependent volume translation to the SRK EOS to
improve the volume prediction both inside and outside the
critical region for some pure polar and nonpolar fluids. The
volume translation was correlated as a function of the critical
parameters, the critical compressibility factor, and the reduced
temperature. Tsai and Chen
14
developed a volume-translated
Peng-Robinson (VTPR) EOS for some polar and nonpolar
fluids, but the volume translation was not generalized. The
VTPR EOS satisfactorily predicted the vapor pressures and both
the saturated vapor and liquid molar volumes, especially for
the polar fluids (e.g., water). de SantAna et al.
15
compared
volume translation techniques for representing the volume
properties of Ungerer and Batut
16
with three other volume
translation methods.
6,9,17
Wang and Gmehling
18
improved the
SRK EOS for representing the volumetric properties of petro-
leum fluids, including the saturated liquid density data and
pressure-volume-temperature (PVT) data under supercritical
conditions. The volume translation was not generalized for any
of the petroleum fluids, except for the n-alkanes. Ahlers and
Gmehling
19
developed a constant volume translation to represent
the saturated liquid densities near and far from the critical point
for polar and nonpolar fluids. Yelash and Kraka
20
analyzed
temperature-dependent and temperature-independent volume
translation methods and gave the criterion for the isotherms
crossing.
21
Lin and Duan
22
developed a new volume translation
method for the PR EOS for representing the liquid density of
different polar and nonpolar fluids, including alkanes, cyclo-
paraffins, halogenated hydrocarbons, olefins, cyclic olefins,
aromatics, and inorganic molecules. All these results show that
the volume translation method can be successfully applied to
the cubic EOS to improve the volumetric properties.
This work presents a volume translation SRK EOS (VTSRK
EOS), using a generalized temperature-dependent volume
translation to represent the volume properties of 198 polar and
nonpolar fluids inside and outside the saturated region.
Development of the Volume Translation
Soave-Redlich-Kwong Equation of State (VTSRK EOS)
According to Martin
2
and Peneloux et al.,
3
the VTSRK EOS
can be translated by an additional term, c, using the volume
translation techniques:
* To whom correspondence should be addressed. Tel.: +86-10-
6279-6318. Fax: +86-10-6277-0209. E-mail address: yyduan@
mail.tsinghua.edu.cn.
P )
RT
V + c - b
-
a
(V + c)(V + b + c)
(1)
1829 Ind. Eng. Chem. Res. 2006, 45, 1829-1839
10.1021/ie051058v CCC: $33.50 2006 American Chemical Society
Published on Web 01/27/2006

http://www.paper.edu.cn
The VTSRK EOS coefficients a and b can be calculated from
the critical parameters in the same way as that for the SRK
EOS:
1
where T
c
and P
c
are the critical temperature and pressure,
respectively. The function R(T) is given by
where T
r
) T/T
c
is the reduced temperature and is the acentric
factor.
Because the constant volume translation, c, cannot accurately
represent the data over the entire saturated region,
19
the
predictions of the critical compressibility factor and volumetric
properties by the VTSRK EOS can be improved by calculating
the volume translation c from the experimental values as
where c
c
is the critical volume translation:
where V
SRK
is the volume calculated by the original SRK and
V
exp
is the experimental value. The temperature-dependent
function, f(T
r
), is given by
where and are two parameters that can be determined by
fitting experimental liquid densities. At the reduced temperature
T
r
) 1.0, the f-function in eq 8 is unity and the volume
translation must be equal to the critical volume translation.
Therefore, the critical compressibility factor calculated by the
VTSRK EOS is the experimental critical compressibility factor.
The parameters in eq 8 were optimized by minimizing the
objective function:
where N is the number of experimental data points and (F
i
)
cal
and (F
i
)
exp
are the densities calculated from the VTSRK EOS
and the experimental data, respectively.
The VTSRK EOS can also be used for volumetric calculations
for nonpolar and polar binary mixtures when the following
mixing rules are used:
where x
i
is the mole fraction of component i, a
ii
and a
jj
are the
cohesive energies, b
i
is the volumetric parameter of component
i, and c
i
is the volume translation of component i, and k
ij
is the
binary interaction coefficient.
Results for Pure Fluids
Saturated Fluids. The fit parameters and for the
temperature-dependent volume translation, which are listed in
Tables 1-4, were optimized using the experimental saturated
liquid densities for many polar and nonpolar fluids. Figures 1
and 2 show the relationship between and and the critical
compressibility factor. The two parameters can be generalized
by
The generalized VTSRK EOS is defined by eqs 1-8, eq 14,
and eq 15. The saturated liquid densities calculated by the
generalized VTSRK EOS are compared with the experimental
data and the results are listed in Tables 1-4, which also includes
the critical temperature and pressure, and the critical compress-
Figure 1. Variation of the volume translation parameter in eq 8 with the
critical compressiblity factor Zc for many polar and nonpolar pure fluids.
Figure 2. Variation of the volume translation parameter in eq 8 with the
critical compressibility factor Zc for many polar and nonpolar fluids.
c
c
) (V
SRK
)
c
- (V
exp
)
c
)
(
1
3
- Z
c)
RT
c
P
c
(7)
f(T
r
) ) + (1 - ) exp(|1 - T
r
|) (8)
F )
1
N

i)1
N
|
(F
i
)
cal
- (F
i
)
exp
(F
i
)
exp
|
(9)
a
m
)

i)1
2

j)1
2
x
i
x
j
a
ij
(10)
a
ij
) (1 - k
ij
)a
i
1/2
a
j
1/2
(11)
b
m
)

i)1
2
x
i
b
i
(12)
c
m
)

i)1
2
x
i
c
i
(13)
) -3.7303 exp
[
-60.2833
(
1
3
- Z
c)]
+ 0.2334 (14)
) -3.4620 exp
[
16.0813
(
1
3
- Z
c)]
- 4.0957 (15)
a ) 0.42748
(
R
2
T
c
2
P
c
)
R(T) (2)
b ) 0.08664
(
RT
c
P
c
)
(3)
R(T) ) [1 + m(1 - T
r
0.5
)]
2
(4)
m ) 0.480 + 1.574 - 0.176
2
(5)
c(T) ) c
c
f(T
r
) (6)
1830 Ind. Eng. Chem. Res., Vol. 45, No. 5, 2006

http://www.paper.edu.cn
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1834 Ind. Eng. Chem. Res., Vol. 45, No. 5, 2006

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5
.
Ind. Eng. Chem. Res., Vol. 45, No. 5, 2006 1835

http://www.paper.edu.cn
ibility factor. The critical parameters of the heavy compounds
(beyond 10 carbon atoms) in Tables 1-4 are probably obtained
by empirical extrapolation rather than by true measurements,
because these compounds undergo rapid thermal degradation
at their critical point. Many volume translation methods have
been proposed to improve the volume calculations of the SRK
EOS, but some are only applicable to certain materials and have
not been generalized. Therefore, the generalized VTSRK EOS
presented here is only compared with the temperature-dependent
translation method given by the VTPR,
22
original PR,
44
PT,
45
and SRK
1
EOSs and by Ji and Lempes method
12,13
in Tables
1-4. The average relative deviation of the experimental
saturated liquid data from the calculated values of the present
generalized VTSRK EOS is 1.81%, which is better than the
original PR
44
(6.19%), PT
45
(4.32%) and SRK
1
(13.39%) EOSs,
and Ji and Lempes method
12,13
(2.78%). The results of the
generalized VTSRK EOS are as good as the VTPR EOS
22
(1.79%) and show distinct improvements for the original SRK
1
EOS for alkanes, olefins, alkines, cycloolefins, alcohols, aromat-
ics, ketones, halogenated hydrocarbons, and inorganic molecules.
Supercritical Fluids. For supercritical fluids, the volume
translation parameter c is temperature independent and can be
represented by eq 8 at T
r
) 1.5. Therefore, the f-function for
the volume translation is given as
The volumetric properties of the supercritical fluids can then
be calculated with the VTSRK EOSs, using eqs 1-7 and eqs
14-16. The calculated densities are compared with the standard
EOSs
45-49
and the average relative deviations are listed in Table
5. The results show that the proposed VTSRK EOS more
accurately represents the supercritical density, compared to the
original PR and SRK EOS. The VTSRK EOS has almost the
same accuracy as the results of Wang and Gmehling
18
but with
a wider application range. Ji and Lempes method
12,13
and the
VTPR
22
EOS can predict liquid densities well for nonpolar fluids
in the supercritical region but are not proper for the polar fluids.
The temperature-dependent volume translation parameter c is
not used for the cubic EOS to predict the liquid densities in the
supercritical region. If the constant c is used for the VTPR
22
EOS as eq 16, good results would be obtained. The pressure
range for each reduced temperature T
r
is up to 60 MPa in Table
5.
Therefore, the f-function for the volume translation proposed
here for the entire temperature region is given as
where the and can be calculated by eqs 14 and 15.
Results for Binary Mixtures
Introduction of the volume translation parameter c did not
change the accuracy of the vapor-liquid equilibrium (VLE)
calculations, because c was canceled when calculating the
fugacity. The generalized VTSRK EOS also has better precision
in calculating the liquid densities for various types of binary
mixtures. Table 6 lists the average relative deviations of the
experimental data from the generalized VTSRK, VTPR, PR,
PT, and SRK EOSs and Ji and Lempes method
12,13
for liquid
densities of mixtures at atmospheric pressure. Some substances
listed in Table 6 were not used to generalize eqs 14 and 15,
including 2-propanol, methyl methacrylate, and diethyl ether.
The binary interaction coefficients k
ij
for these mixtures are equal
to zero. The results in Table 6 show that the average relative
deviation of the present VTSRK EOS is <1.23%, which is better
than the other methods (5.95% for the PR EOS; 15.66% for
the SRK EOS; 2.39% for the PT EOS; 4.27% for the Ji and
Lempe method
12,13
). The VTPR
22
EOS has better deviation
(0.72%) than the VTSRK EOS, but the VTSRK EOS makes a
huge improvement for the original SRK EOS (15.66% f
1.23%).
Discussions
The temperature-dependent translation can lead to (b - c) <
0 in the repulsive term
12
and crossed isotherms at high
pressures.
20,21
For the repulsive term b - c, we have
Table 5. Comparison of Densities for Pure Fluids under
Supercritical Conditions
F (%)
T
r PR SRK PT
refs 12
and 13 ref 22 ref 17
this
work
Argon (data from ref 46)
1.01 9.79 2.20 2.75 2.34 21.55 2.55
1.05 9.19 2.22 2.67 2.32 11.64 2.50
1.50 5.09 1.84 1.29 1.77 1.03 1.59
3.00 2.33 1.08 0.41 1.07 0.17 0.84
average 6.60 1.84 1.78 1.88 8.60 1.87
N
2 (data from ref 47)
1.01 10.82 2.31 3.94 2.70 25.78 3.30 2.46
1.05 10.42 2.32 2.65 2.65 14.04 3.23 2.46
1.50 7.00 1.76 2.27 1.79 1.22 2.06 1.79
3.00 3.57 0.68 0.87 0.67 0.38 0.70 0.66
average 7.95 1.77 2.43 1.95 10.36 2.32 1.84
CO
2 (data from ref 48)
1.01 3.62 7.38 2.72 3.29 24.81 3.14 3.17
1.05 3.35 7.31 2.69 3.66 9.32 3.25 3.29
1.50 1.02 5.59 1.79 4.59 2.27 3.37 3.42
3.00 0.24 2.17 0.61 1.99 0.82 1.19 1.21
average 2.06 5.61 1.95 3.38 9.31 2.74 2.77
1,1,1,2-Tetrafluoroethane (data from ref 49)
1.01 2.51 10.51 2.58 95.18 44.49 3.72
1.05 2.61 10.27 2.73 28.68 14.62 3.71
average 2.56 10.39 2.67 61.93 29.56 3.72
1,1,1-Trifluoroethane (data from ref 50)
1.01 4.12 13.18 5.25 33.83 48.28 3.55
1.05 4.18 12.85 5.20 18.37 13.75 3.57
average 4.15 13.02 5.23 26.10 31.02 3.56
f(T
r
) ) + (1 - ) exp(0.5) (16)
Figure 3. Relationship between the reduced temperature (Tr) and the
compressiblity factor (Zc), and the temperature interval of (b - c) < 0.
f(T
r
) )
{
+ (1 - ) exp[(1 - T
r
)] (for T
r
e 1)
+ (1 - ) exp(0.5) (for T
r
> 1)
(17)
b - c )
[
0.08664 -
(
1
3
- Z
c)
f(T
r
)
]
RT
c
p
c
< 0 (18)
1836 Ind. Eng. Chem. Res., Vol. 45, No. 5, 2006

http://www.paper.edu.cn
Considering f(T
r
) e1, eq 18 can be solved and Z
c
< 0.2467.
For the compounds listed in Tables 1-4, the range of Z
c
is from
0.2130 to 0.3050. Therefore, when 0.2130 < Z
c
< 0.2467, (b
- c) < 0 can happen. Furthermore, the temperature interval of
(b - c) < 0 for the compressibility factor Z
c
can be solved,
and the results are shown in Figure 3. The space between the
solution line and T
r
) 1.0 is the temperature zone of (b - c) <
0, which can be determined by
Therefore, (b - c) < 0 can happen when 0.2130 < Z
c
< 0.2467
and the temperature zone is determined by eq 19. When T
r
>
1.0, the constant translation eq 16 is adopted and (b - c) > 0.
Many temperature-dependent translations have been checked
by the Yelash and Kraska criterion,
20
and the results show that
all of the temperature-dependent translations can lead to the
crossed isotherms. However, the crossed isotherm is only
observed at very high pressure in the liquid phase and the
pressure is far away from the saturated pressure. For argon, the
isotherm line T
r
) 0.6 crossed the isotherm lines T
r
) 0.7, 0.8,
and 0.9 at pressures of 360, 150, and 55 MPa while the saturated
pressure was 0.136 MPa. For CH
4
, the isotherm line T
r
) 0.55
crossed the isotherm lines T
r
) 0.65, 0.75, and 0.85 at pressures
of 720, 310, and 110 MPa while the saturated pressure is 0.053
MPa. For 1,1,1,2-tetrafluoroethane, the isotherm line T
r
) 0.55
crossed the isotherm lines T
r
) 0.65, 0.75, and 0.85 at pressures
of 2020, 648, and 165 MPa and the saturated pressure is 0.0095
Table 6. Comparison of Liquid Densities at Atmospheric Pressure of Binary Mixtures Using the Generalized VTSRK EOS and Other Methods
F (%)
mixture T (K) N PR SRK PT refs 12 and 13 ref 22 VT SRK F
L reference(s)
nC5 + nC6 298.14 11 1.80 9.83 0.85 1.49 0.30 0.74 51
nC5 + nC7 298.14 11 1.23 10.72 0.58 2.60 0.46 0.23 51
nC5 + nC8 298.14 11 1.93 11.92 0.58 3.16 0.52 0.22 51
nC5 + nC9 298.14 11 2.56 12.62 0.62 3.35 0.23 0.56 51
nC5 + nC10 298.14 11 3.72 13.79 1.03 3.51 0.14 0.88 51
nC5 + nC11 298.14 11 5.11 15.06 1.42 3.68 0.48 1.35 51
nC5 + nC12 298.14 11 6.25 16.13 2.13 3.96 0.39 1.37 51
nC6 + nC7 298.14 20 0.52 11.56 0.31 2.94 0.39 0.47 51, 52
nC6 + nC8 298.14 20 1.76 12.71 0.44 3.47 0.42 0.45 51, 52
nC6 + nC9 298.14 20 2.68 13.19 0.88 3.73 0.59 1.22 51, 52
nC6 + nC10 298.14 20 3.95 14.30 1.40 3.95 0.80 1.69 51, 52
nC6 + nC11 298.14 11 4.97 15.38 1.33 3.80 0.63 1.55 51
nC6 + nC12 298.14 14 6.41 16.64 2.11 4.16 0.57 1.62 51, 52
nC7 + nC8 298.14 20 2.43 13.31 0.47 4.33 0.89 0.06 51, 52
nC7 + nC9 298.14 20 3.15 13.90 0.56 4.46 0.59 0.40 51, 52
nC7 + nC10 298.14 20 4.41 14.98 1.08 4.55 0.37 0.77 51, 52
nC7 + nC11 298.14 11 5.41 15.83 1.37 4.56 0.54 1.17 51
nC7 + nC12 298.14 14 6.81 17.03 2.16 4.88 0.51 1.25 51, 52
nC8 + nC9 298.14 20 4.20 14.79 1.04 4.83 0.58 0.44 51, 52
nC8 + nC10 298.14 20 5.33 15.75 1.51 4.90 0.35 0.79 51, 52
nC8 + nC11 298.14 11 6.32 16.59 1.79 4.90 0.54 1.21 51
nC8 + nC12 298.14 14 7.61 17.71 2.54 5.19 0.50 1.30 51, 52
nC9 + nC10 298.14 20 5.83 16.16 1.53 4.95 0.16 1.13 51, 52
nC9 + nC11 298.14 11 6.79 16.98 1.82 4.96 0.47 1.54 51
nC9 + nC12 298.14 14 8.02 18.04 2.55 5.22 0.44 1.63 51, 52
nC10 + nC11 298.14 11 7.72 17.77 2.23 4.99 0.71 1.86 51
nC10 + nC12 298.14 14 8.86 18.76 2.92 5.24 0.69 1.96 51, 52
nC11 + nC12 298.14 11 9.62 19.41 3.13 5.21 1.03 2.35 51
H
2O + methanol 298.15 21 17.64 25.85 12.35 4.51 1.52 1.73 53
H2O + ethanol 298.15 21 11.32 21.15 5.95 4.29 1.63 1.62 53
1-octanol + methanol 298.15 21 7.51 18.89 2.67 5.59 0.56 0.68 53
1-octanol + ethanol 298.15 21 4.09 16.25 2.13 4.72 0.81 1.89 53
1-octanol + H2O 298.15 6 4.90 17.30 3.71 6.23 1.03 0.91 53
toluene + nC8 293.15-313.15 48 2.23 13.05 1.08 3.98 0.55 0.43 54
toluene + nC10 293.15-313.15 48 4.45 14.93 1.75 4.30 0.29 1.11 54
toluene + nC12 293.15-313.15 48 7.27 17.37 3.00 4.75 0.55 1.58 54
toluene + nC14 293.15-313.15 48 17.05 18.77 3.21 6.81 1.00 0.43 54
ethylbenzene + nC8 293.15-313.15 47 2.81 13.43 1.16 4.45 0.86 0.24 54
ethylbenzene + nC14 293.15-313.15 48 16.92 18.84 3.14 7.04 1.17 0.39 54
nC6 + 1-butanol 298.15 11 0.59 11.09 3.87 2.05 1.40 2.39 55
nC6 + 1-hexanol 298.15 11 0.84 11.40 3.32 3.17 0.47 1.56 55
nC6 + 1-octanol 298.15 11 0.73 12.57 2.00 3.37 0.64 1.85 55
nC8 + 1-butanol 298.15 11 2.45 13.29 2.76 3.98 0.68 1.48 56
nC8 + 1-hexanol 298.15 11 2.88 13.55 2.08 4.96 0.68 0.72 56
nC8 + 1-octanol 298.15 11 2.70 14.54 1.16 5.05 0.27 1.14 56
2-propanol + nC8 293.15-303.15 36 3.64 14.33 2.42 3.56 1.19 1.38 57
2-propanol + nC10 293.15-303.15 38 5.93 16.27 2.26 4.13 1.04 1.78 57
2-propanol + nC12 293.15-303.15 38 8.71 18.68 3.05 4.76 1.12 2.03 57
methyl methacrylate + benzene 298.15-318.15 55 3.28 13.72 4.57 3.47 1.05 0.91 58
methyl methacrylate + p-xylene 298.15-318.15 55 3.82 15.74 5.30 4.82 1.46 0.84 58
methyl methacrylate + diethyl ether 298.15 11 3.42 14.44 4.30 2.98 1.10 0.95 58
methyl methacrylate + toluene 298.15-318.15 55 3.72 14.64 4.91 4.17 1.30 0.89 58
methyl methacrylate + cyclohexane 298.15-318.15 55 2.87 11.84 3.05 2.50 0.64 0.99 58
methyl methacrylate + diisopropyl ether 298.15-318.15 55 2.77 11.89 3.42 2.03 1.64 1.90 58
average 5.95 15.66 2.39 4.27 0.72 1.23
0.6107 + 6.0364Z
c
- 33.0204Z
c
2
+ 60.5956Z
c
3
eT
r
e1.0
(19)
Ind. Eng. Chem. Res., Vol. 45, No. 5, 2006 1837

http://www.paper.edu.cn
MPa. When the temperature is very close to the critical
temperature, the isotherm crossing can be avoided at p ep
c
.
The temperature-dependent volume translation correction is
only an empirical approach, but it is still useful in the
improvement of the constant compressibility factor and liquid
volumetric properties prediction for the original EOS.
Conclusions
A new temperature-dependent volume translation was de-
veloped to improve the volume prediction properties of the
Soave-Redlich-Kwong (SRK) equation of state (EOS) for pure
fluids and mixtures. The volume translation was generalized as
a function of the critical parameters of the pure fluids and
reduced temperature. The generalized volume translation SRK
EOS (VTSRK EOS) accurately represents the critical compress-
ibility factor and the liquid densities of pure fluids and mixtures.
Symbols
a ) cohesive energy parameter in the SRK equation of state
(Pa m
6
/mol
2
)
b ) volumetric parameter in the SRK equation of state (m
3
/
mol)
c ) temperature-dependent volume translation parameter in the
SRK equation of state
EOS ) equation of state
f ) temperature-dependent function for the volume correction
F ) objective function
k ) binary interaction coefficients
N ) number of data points
P ) pressure (Pa)
R ) molar gas constant; R ) 8.314471 J mol
-1
K
-1
T ) temperature (K)
V ) molar volume (m
3
/mol)
VTSRK )volume translation Soave-Redlich-Kwong equation
of state
Z ) compressibility factor
Greek Letters
R ) temperature-dependent function for the PR EOS
, ) fitted parameters in the temperature-dependent volume
correction function
) average relative deviation (%)
F ) density
Subscripts
c ) critical point
exp ) experimental value
i ) component i
j ) component j
m ) mixture
r ) reduced
Acknowledgment
This work was supported by the National Natural Science
Foundation of China (No. 50225622) and the Foundation for
the Author of National Excellent Doctoral Dissertation of the
Peoples Republic of China (No. 200336).
Literature Cited
(1) Soave, G. Equilibrium Constants from a Modified Redlich-Kwong
Equation of State. Chem. Eng. Sci. 1972, 27, 1197-1203.
(2) Martin, J. J. Equations of State-Applied Thermodynamics Sympo-
sium. Ind. Eng. Chem. 1967, 59 (12), 34-52.
(3) Peneloux, A.; Rauzy, E. A Consistent Correction for Redlich-
Kwong-Soave Volumes. Fluid Phase Equilib. 1982, 8, 7-23.
(4) Watson, P.; Cascella, M.; May, D.; Salerno, S.; Tassios, D. Prediction
of Vapor Pressures and Saturated Molar Volumes with a Simple Cubic
Equation of State: Part II: The van der Waals-711 EOS. Fluid Phase
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ReceiVed for reView September 20, 2005
ReVised manuscript receiVed December 4, 2005
Accepted January 4, 2006
IE051058V
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