Fugacities

Peng-Robinson Equation of State (Mixture)

Fugacities

kij
Component zi Tc (K) Pc (MPa) w methane ethane propane in begnning the critical temperature and critical pressure from NIST website
methane 0.7 190.6 4.064 0.011 - - - then current temperature and pressure was fixed.
ethane 0.2 305.4 4.88 0.099 0 - - then compressiblity factor was measured by equation:
propane 0.1 369.8 4.249 0.152 0 0 - z3 + az2 + bz + c = 0
a,b,c are constants of equation and R is root of equation. R is measured by following equation:
Current State Roots R = q2/4 + p3/27
T (K) 373.98 Z V fugacity component fugacity coeff component fugacity(MPa) mixture as the value of R is positive so the root is real and single root is estimated
P (MPa) 2 cm3/gmol MPa methane ethane propane methane ethane propane A 0.06509584 then molar volume is measured by following equation:
answers for three #VALUE! #VALUE! #VALUE! #VALUE! #VALUE! #VALUE! #VALUE! #VALUE! #VALUE! B 0.02248691 V = ZRTK/P
root region #VALUE! #VALUE! R(cm MPa/molK)
3 then reduced temperature is measured as follow
#VALUE! #VALUE! #VALUE! #VALUE! #VALUE! #VALUE! #VALUE! #VALUE! #VALUE! 8.314 Tr = T/Tc
& for 1 root region 0.959145 1491.12 1.91820916 0.98172879 0.92440738 0.87698495 1.37442 0.369763 0.175397 reduced pressure is
P= P/Pc
A Keppa K is measured by following formula
Tr Pr k a ac a b A B methane ethane propane k is keppa =0.37464+1.54226*w-0.26993*w^2 from equation 6.7-4. chemical, biochemical engineering thermodynamics
methane 1.96212 0.492126 0.391572 0.71077508 282521.89 200809.519 30.335 0.041543 0.019512 0.041543 0.068022 0.093182
ethane 1.224558 0.409836 0.524678 0.891269367 604057.461 538377.912 40.478 0.111378 0.026037 0.0680219 0.111378 0.152575 then the α , ac, a, b are measured from critical temperature and pressure as follow
propane 1.011303 0.470699 0.602827 0.99321669 1017201.74 1010301.74 56.292 0.209009 0.036209 0.0931818 0.152575 0.209009 α is 1+k*((1-Tr)^0.5))^2 from equation 6.7-3. chemical, biochemical engineering thermodynamics
ac is 0.45*R^2*Tc^2/Pc from equation 6.7-1 chemical, biochemical engineering thermodynamics
Solution to Cubic Z3 + a2Z2 + a1Z + a0 =0 a is ac*α
R = q2/4 + p3/27 = 2.72832E-05 β is 0.077*R*Tc/Pc from equation 6.7-2 chemical, biochemical engineering thermodynamics
a2 a1 a0 p q If Negative, three unequal real roots, then fugacity can be calculated from equation 7.4-14a
-0.97751 0.018605 -0.00095 -0.29991 -0.06407306 If Positive, one real root then fugacity coefficent can be found by equation 9.4-10
then same process repeated to get table
Method 1 - For region with one real root A and B is calculated from pg 425, chapter 9.4, book chemical, biochemical engineering thermodynamics
P Q Root to equation in x
0.334 0.299307 0.633307 .

Method 2 - For region with three real roots

m 3q/pm 3*q1 q1 Roots to equation in x
0.632356 1.013563 #VALUE! #VALUE! #VALUE! #VALUE! #VALUE!

Page 1
P(bar) P(MPa) Z fmethane fethane fpropane
5 0.5 0.989451 0.348328 0.098043 0.048379
10 1 0.979117 0.693409 0.192263 0.093628
20 2 0.959145 1.37442 0.369763 0.175397