hmx.bnc

一个关于物性计算的软件

HMX               !mnemonic for mixture model, must match hfmix on call to SETUP

! compiled by M. McLinden, NIST Thermophysics Division, Boulder, Colorado
! 01-08-96  MM, original version
! 05-06-96  MM, rearrange sequence of parameters:  Kt, Kv first
!               add new model MKT:  Tc by geometric mean, Kt is only parameter
! 05-08-96  MM, add descriptors for binary-specific parameters
! 05-10-96  MM, add default (ideal-solution) values for binary parameters
! 05-29-96  MM, add LJ1, LJ2, LJ3 from Lemmon's thesis
! 06-10-96  MM, add binary coefficients from Lemmon's thesis; change MKT to VDW
! 06-12-96  MM, replace LJi rule with modified L-J (LMi) for several mixtures
! 07-01-96  MM, tranform R32-specific terms in LM2, LM3 into LM1 form
! 10-11-96  MM, add parameters for R32/143a, R125/143a, R143a/134a
! 10-18-96  MM, add parameters for R32/propane, R125/propane, propane/R134a
! 11-04-96  MM, replace van der Waals with linear rule, expand binary par to 6
! 11-06-96  MM, revise Kt, Kv to conform with linear mixing rule,
!               revise parameters specific to R32 mixtures (LM2 and LM3)
! 11-14-96  MM, add R41/CO2 parameters, add LM9 model
! 11-19-96  MM, add parameters for critical line (dummy coeff for now)
! 11-27-96  MM, add critical line parameters, values fitted by E. Lemmon
! 05-21-97  MM, update mixture-specific generalized parameters rec'd from EWL 5-8-97
!               add remaining binaries from EWL thesis (but don't have critical lines yet)
! 05-22-97  MM, change format for coeff to f12.x
! 05-23-97  MM, update coefficients using values from EWL rec'd 5-8-97
! 06-05-97 EWL, update coefficients, correct gamma = 0 to gamma = 1
! 07-11-97  MM, had incorrect CAS # for R152a, affected R12/152a (R500), R22/152a, R134a/152a
! 11-12-97  MM, add 60 mixtures fitted by E.W. Lemmon
! 11-14-97  MM, add critical line fits by E.W. Lemmon for the above 60 binary mixtures
! 01-14-98 EWL, add critical line fits for hydrocarbon mixtures
! 05-13-98 EWL, removed information for C2/iC4, C4/CO2, iC4/N2, iC4/CO2, N2/Ne
!               and Ar/Ne for which the parameters had not been fit.
! 10-02-98 EWL, update coefficients with most current values
! 12-16-98 EWL, add ammonia-water coefficients from NH3_H2O.bnc
! 03-02-99 EWL, add temporary coefficients for helium mixtures
! 03-03-99 EWL, add coefficients for air constituent mixtures
! 09-01-99 EWL, add 1 additional digit to the critical density reducing parameter
! 09-01-99 EWL, add temporary coefficients for hydrogen mixtures
! 04-17-01 EWL, update R12/R143a, R12/R142b, and R23/R114 parameters,
!               add R134a/R141b, R141b/R142b
! 07-31-01 EWL, add Ar/Kr, C1/Kr
! 08-02-01 EWL, update R22/R124, R22/R143a, R22/R152a, R124-R152a, and R124-R142b
!               parameters
! 08-06-01 EWL, update R12/R22 and R22/R114 parameters
! 08-09-01 EWL, fix LM2 and LM3 coefficients to match new code in MIX_HMX.FOR
! 11-20-01 EWL, update R41/CO2 parameters, remove LM9 model
! 03-21-02 EWL, add fits of C4 and iC4 with R125 and R134a
! 04-25-02 EWL, sort refrigerants by # (for those with 1 parameter)
! 04-25-02 EWL, update R32/143a, R12/22, R22/142b, and R142b/152a
! 04-29-02 EWL, add isobutane with 143a, 152a, 227ea, 23, 32
! 04-29-02 EWL, add C3/143a, C5/152a, C5/22, 22/218, 32/123, 142b/152a, 32/142b
! 04-29-02 EWL, add C1/22, Ar/22, N2/12, N2/22, N2/227ea
! 04-29-02 EWL, update R22/124, R22/152a, and R124/152a
! 05-24-02 EWL, add many new binary mixtures for both hydrocarbons and refrigs
! 06-21-02 EWL, add new mixture models for R32/R125, R32/R134a, and
!               R125/134a/143a/152a.  Name models LJ4, LJ5, and LJ6
! 06-21-02 EWL, update C2/CO2
! 07-22-02 EWL, update all values for TC1 and VC1 except NH3/H2O
! 08-15-02 EWL, update TC1 and VC1 for NH3/H2O


#BNC              !binary mixing coefficients
BNC
?binary mixing coefficients for the various mixing rules used with the HMX model
?LJi:  (i = 1,2,3)
? CAS 1       CAS 2      model     zeta        xi      Fpq       beta     gamma   not used
?
?LMi:  (i = 1,2,3)
? CAS 1       CAS 2      model     Kt          Kv      Fpq       beta     gamma   not used
?
?TR1:
? CAS 1       CAS 2      model     Kv       alpha   not used  not used  not used  not used
?
?LIN:
? CAS 1       CAS 2      model     Kt        Kv     not used  not used  not used  not used
?
?coefficients for binary critical lines
? TC1:  Tc = x1*Tc1 + x2*Tc2 + x2*(a1*x1 + a2*x1**2 + a3*x1**3 + a4*x1**4 + a5*x1**5 + a6*x1**6)
?                        model     a1        a2        a3        a4        a5        a6
?
? VC1:  Vc = x1*Vc1 + x2*Vc2 + x2*(a1*x1 + a2*x1**2 + a3*x1**3 + a4*x1**4 + a5*x1**5 + a6*x1**6)
?                        model     a1        a2        a3        a4        a5        a6
?
? N.B. format for a binary pair must be:
?      line 1:  comments beginning with '?' (these are read by Fortran and displayed by GUI)
?           2:  additional comments beginning with '?' (not read)
?           3:  CAS_1, CAS_2, model, (binary parameters)  in format:  (a12,1x,a12,1x,a3,1x,6f12.x)
?           4:                model, (Tc line parameters) in format:  (26x,a3,1x,6f12.x)
?           5:                model, (Vc line parameters) in format:  (26x,a3,1x,6f12.x)
?           6:  separator line ('!')
?
!
?methane  /ethane
?Lemmon (1996), PhD thesis, U. Idaho
74-82-8     /74-84-0      LJ1    0.0000000  0.00000000   1.0000000   1.0000000   1.0000000   0.0000000
                          TC1   53.7079305  20.0714859  22.9599973   0.0000000   0.0000000   0.0000000
                          VC1    0.0133492  -0.3895559   1.9830937  -4.8012494   5.1741797  -2.1358063
!
?methane  /propane
?Lemmon (1996), PhD thesis, U. Idaho
74-82-8     /74-98-6      LJ1   19.3902890 -0.00266906   1.5563610   1.8822660   1.0000000   0.0000000
                          TC1     113.0715 -35.2751725    423.6354   -293.8335   0.0000000   0.0000000
                          VC1   -0.0059357  -0.9258787   6.0823782 -15.8440966  17.9573265  -7.7734800
!
?methane  /butane
?Lemmon (1996), PhD thesis, U. Idaho
74-82-8     /106-97-8     LJ1   41.1329920  0.00000000   2.4454150   2.0066730   1.0000000   0.0000000
                          TC1     152.0205   -138.7845   1282.0756  -1004.3019   0.0000000   0.0000000
                          VC1   -0.2625893   1.7224289  -0.8559653  -8.8290528  15.8244886  -8.4030215
!
?methane  /isobutane
?Lemmon (1996), PhD thesis, U. Idaho
74-82-8     /75-28-5      LJ1   40.0392170  0.00000000   2.6616640   2.5444090   1.0000000   0.0000000
                          TC1     127.2559 -33.8789309    781.1635   -536.2961   0.0000000   0.0000000
                          VC1   -0.2275618   1.2270649  -1.8503571   0.5108911   0.0000000   0.0000000
!
?methane  /nitrogen
?Lemmon (1996), PhD thesis, U. Idaho
74-82-8     /7727-37-9    LJ1  -17.8186760  0.00381045   0.6341820   1.0000000   1.0000000   0.0000000
                          TC1    5.6769082  11.6151372   0.0000000   0.0000000   0.0000000   0.0000000
                          VC1   -0.0147887  -0.1737558   0.4190229  -0.1895927  -0.3360791   0.2800439
!
?methane  /CO2
?Lemmon (1996), PhD thesis, U. Idaho
74-82-8     /124-38-9     LJ1  -37.2711800  0.00000000   0.8085460   1.0000000   1.0000000   0.0000000
                          TC1   53.1217847 -58.3569424   0.0000000   0.0000000   0.0000000   0.0000000
                          VC1    0.0048320  -0.2184764   0.1657554   0.0000000   0.0000000   0.0000000
!
?methane  /argon
?Lemmon (1996), PhD thesis, U. Idaho
74-82-8     /7440-37-1    LJ1    6.8669160  0.00000000  -1.1373310   1.0000000   1.0000000   0.0000000
                          TC1   45.4051820 -92.2873138    257.8543   -328.6289    161.9259   0.0000000
                          VC1   -0.0357470   0.1527664  -0.4166104   0.6241569  -0.4117957   0.0929540
!
?ethane   /propane
?Lemmon (1996), PhD thesis, U. Idaho
74-84-0     /74-98-6      LJ1    3.7450190 -0.00154638   0.1068420   1.0000000   1.0000000   0.0000000
                          TC1   25.3237737   1.8464959  12.0414870   0.0000000   0.0000000   0.0000000
                          VC1    0.0633060  -0.4749115   1.2606076  -1.4549727   0.5947883   0.0000000
!
?ethane   /butane
?Lemmon (1996), PhD thesis, U. Idaho
74-84-0     /106-97-8     LJ1    0.0000000  0.00000000   0.7595280   1.0000000   1.0000000   0.0000000
                          TC1   46.4061239  33.8165893  26.1856798   0.0000000   0.0000000   0.0000000
                          VC1   -0.0343022   0.4618388  -1.4343065   1.7127348  -0.7690714   0.0000000
!
?ethane   /nitrogen
?Lemmon (1996), PhD thesis, U. Idaho
74-84-0     /7727-37-9    LJ1  -17.8646940  0.00964861   1.0214630   1.2334770   1.0000000   0.0000000
                          TC1   70.7823207   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
                          VC1    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
!
?ethane   /CO2
?Lemmon (2002)
74-84-0     /124-38-9     LJ6  -60.58        0.00512    -1.432       1.0000000   1.0000000   0.0000000
                          TC1  -49.5564332 -52.8344365    104.9461 -31.4572859   0.0000000   0.0000000
                          VC1   -0.0169449  -0.0453275   0.8177764  -1.7110950   1.1725649  -0.1784456
!
?propane  /n-butane (R290/600) based on PVT data of Parrish (RMS dev = 0.06%)
?Lemmon (1996), PhD thesis, U. Idaho
74-98-6     /106-97-8     LJ1    0.0000000  0.00000000   0.1666900   1.0000000   1.0000000   0.0000000
                          TC1   11.8898300   1.4303380   4.4981115   0.0000000   0.0000000   0.0000000
                          VC1   -0.0172391   0.1648133  -0.3865682   0.2800738   0.0000000   0.0000000
!
?propane  /isobutane (R290/600a) based on PVT data of Kahre (RMS dev = 0.30%)
?Lemmon (1998)
74-98-6     /75-28-5      LJ1    4.7749130  0.00000000   0.0378110   1.0000000   1.0000000   0.0000000
                          TC1   13.2320741  -0.0313081   5.4251101   0.0000000   0.0000000   0.0000000
                          VC1    0.0664190  -0.1989280   0.1736827   0.0000000   0.0000000   0.0000000
!
?propane  /nitrogen
?Lemmon (1996), PhD thesis, U. Idaho
74-98-6     /7727-37-9    LJ1  -22.3391550  0.00952804   1.8949610   4.3677400   1.0000000   0.0000000
                          TC1     100.0742   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
                          VC1    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
!
?propane  /CO2
?Lemmon (1996), PhD thesis, U. Idaho
74-98-6     /124-38-9     LJ1  -68.5401380  0.00000000  -0.4454280   1.0000000   1.2352280   0.0000000
                          TC1  -41.1966937  47.0405320    168.7362   -128.3131   0.0000000   0.0000000
                          VC1    0.0411971  -0.1725767   0.1773478  -0.3024753   0.3659764   0.0000000
!
?butane   /isobutane (R600/600a) based on PVT data of Kahre (RMS dev = 0.02%)
?Lemmon (1996), PhD thesis, U. Idaho
106-97-8    /75-28-5      LJ1    0.0000000  0.00000000   0.0363290   1.0000000   1.0000000   0.0000000
                          TC1    0.5324648   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
                          VC1    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
!
?butane   /nitrogen
?Lemmon (1996), PhD thesis, U. Idaho
106-97-8    /7727-37-9    LJ1  112.8092200 -0.02506125  -2.3100960   1.1940890   1.0000000   0.0000000
                          TC1     484.0418   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
                          VC1    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
!
?nitrogen /CO2
?Lemmon (1996), PhD thesis, U. Idaho
7727-37-9   /124-38-9     LJ1  -31.1493000  0.00659978   2.7806470   1.0000000   1.0000000   0.0000000
                          TC1   98.5442355   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
                          VC1   -0.0228544  -0.2447025   0.0000000   0.0000000   0.0000000   0.0000000
!
?nitrogen /argon
?Lemmon (1999), JPCRD 29:331
7727-37-9   /7440-37-1    LJ3   -1.2377130 -0.00076031   1.1215270   1.0000000   1.0000000   0.0000000
                          TC1   -1.3048977   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
                          VC1    0.0181366  -0.0058369  -0.0828875   0.2755215  -0.3330214   0.1695274
!
?nitrogen /oxygen
?Lemmon (1999), JPCRD 29:331
7727-37-9   /7782-44-7    LJ3   -0.8563500 -0.00041847   1.0000000   1.0000000   1.0000000   0.0000000
                          TC1    0.4086706   1.1229194   0.0000000   0.0000000   0.0000000   0.0000000
                          VC1    0.0006630   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
!
?argon    /oxygen
?Lemmon (1999), JPCRD 29:331
7440-37-1   /7782-44-7    LJ3   -2.1151260  0.00041232   0.5972030   1.0000000   1.0000000   0.0000000
                          TC1   -4.0004345  -1.0112386   0.0000000   0.0000000   0.0000000   0.0000000
                          VC1    0.0311585  -0.0367439   0.0564346   0.0000000   0.0000000   0.0000000
!
?argon    /CO2
?Lemmon (1996), PhD thesis, U. Idaho
7440-37-1   /124-38-9     LJ1    0.0000000  0.00000000  -0.1381730   1.0000000   1.0000000   0.0000000
                          TC1     145.9925 -74.8644828   0.0000000   0.0000000   0.0000000   0.0000000
                          VC1    0.0352716  -0.4040896   0.2982756   0.0000000   0.0000000   0.0000000
!
?R32      /R125