Table 5. Unlike Group Parameters (Excluding Association) for Use with the SAFT-γ Mie Approacha.
| k | l | group k | group l | (εkl/kB)/K | λrkl | ref |
|---|---|---|---|---|---|---|
| 1 | 1 | cCOO | cCOO | 763.67 | 11.855 | * |
| 1 | 2 | cCOO | cCH2 | 414.07 | 11.043 | * |
| 1 | 3 | cCOO | cCH | 519.28 | 8.2819 | * |
| 1 | 4 | cCOO | CH3 | 411.61 | 33.394 | * |
| 1 | 5 | cCOO | CH2 | 618.67 | 31.395 | * |
| 1 | 6 | cCOO | CH | 0.0000 | CR | * |
| 1 | 7 | cCOO | CH3OH | 434.59 | CR | * |
| 1 | 8 | cCOO | CH2OH | 500.14 | CR | * |
| 1 | 9 | cCOO | CHOH | 373.30 | CR | * |
| 1 | 10 | cCOO | CH3COCH3 | 482.68 | CR | * |
| 1 | 11 | cCOO | CH3CO | 625.98 | CR | * |
| 1 | 12 | cCOO | COO | 756.57 | 9.9399 | * |
| 1 | 13 | cCOO | aCH | 543.64 | 17.749 | * |
| 1 | 14 | cCOO | aCCH3 | 460.79 | 9.2834 | * |
| 1 | 15 | cCOO | aCCH2 | 464.16 | 8.0000 | * |
| 1 | 16 | cCOO | H2O | 419.86 | CR | * |
| 1 | 17 | cCOO | CO2 | 261.21 | 8.0000 | * |
| 2 | 2 | cCH2 | cCH2 | 477.36 | 20.386 | (51) |
| 2 | 3 | cCH2 | cCH | 321.71 | CR | (41) |
| 2 | 4 | cCH2 | CH3 | 355.95 | CR | (51) |
| 2 | 5 | cCH2 | CH2 | 469.67 | CR | (51) |
| 2 | 6 | cCH2 | CH | 570.45 | CR | (51) |
| 2 | 7 | cCH2 | CH3OH | 361.42 | CR | (68) |
| 2 | 8 | cCH2 | CH2OH | 424.64 | CR | (68) |
| 2 | 9 | cCH2 | CHOH | 554.50 | CR | (11) |
| 2 | 10 | cCH2 | CH3COCH3 | 352.19 | CR | (11) |
| 2 | 11 | cCH2 | CH3CO | 435.86 | CR | (68) |
| 2 | 12 | cCH2 | COO | 498.60 | CR | (36) |
| 2 | 13 | cCH2 | aCH | 393.05 | 15.377 | (39) |
| 2 | 14 | cCH2 | aCCH3 | 540.63 | 21.082 | (39) |
| 2 | 15 | cCH2 | aCCH2 | 439.78 | 9.9058 | (39) |
| 2 | 16 | cCH2 | H2O | 350.99 | 28.000 | (41) |
| 2 | 17 | cCH2 | CO2 | 269.68 | CR | (42) |
| 3 | 3 | cCH | cCH | 699.92 | 8.0000 | (41) |
| 3 | 4 | cCH | CH3 | 690.17 | CR | (41) |
| 3 | 5 | cCH | CH2 | 522.57 | CR | (41) |
| 3 | 6 | cCH | CH | 0.0000 | CR | (68) |
| 3 | 7 | cCH | CH3OH | 345.00 | CR | (68) |
| 3 | 8 | cCH | CH2OH | 242.45 | CR | (68) |
| 3 | 9 | cCH | CHOH | 640.38 | CR | * |
| 3 | 10 | cCH | CH3COCH3 | 409.28 | CR | (68) |
| 3 | 11 | cCH | CH3CO | 265.24 | CR | (68) |
| 3 | 12 | cCH | COO | 0.0000 | CR | (68) |
| 3 | 13 | cCH | aCH | 377.21 | CR | (39) |
| 3 | 14 | cCH | aCCH3 | 792.29 | CR | (39) |
| 3 | 15 | cCH | aCCH2 | 162.65 | CR | (39) |
| 3 | 16 | cCH | H2O | 377.16 | 22.265 | (41) |
| 3 | 17 | cCH | CO2 | 294.99 | CR | (42) |
| 4 | 4 | CH3 | CH3 | 256.77 | 15.050 | (8) |
| 4 | 5 | CH3 | CH2 | 350.77 | CR | (8) |
| 4 | 6 | CH3 | CH | 387.48 | CR | (51) |
| 4 | 7 | CH3 | CH3OH | 275.76 | 15.537 | (51) |
| 4 | 8 | CH3 | CH2OH | 333.20 | CR | (36) |
| 4 | 9 | CH3 | CHOH | 479.38 | CR | (11) |
| 4 | 10 | CH3 | CH3COCH3 | 233.48 | 14.449 | (51) |
| 4 | 11 | CH3 | CH3CO | 344.57 | CR | (39) |
| 4 | 12 | CH3 | COO | 402.75 | CR | (8) |
| 4 | 13 | CH3 | aCH | 305.81 | CR | (51) |
| 4 | 14 | CH3 | aCCH3 | 358.58 | CR | (36) |
| 4 | 15 | CH3 | aCCH2 | 396.91 | CR | (51) |
| 4 | 16 | CH3 | H2O | 358.18 | 100.00 | (36) |
| 4 | 17 | CH3 | CO2 | 205.70 | CR | (90) |
| 5 | 5 | CH2 | CH2 | 473.39 | 19.871 | (8) |
| 5 | 6 | CH2 | CH | 506.21 | CR | (51) |
| 5 | 7 | CH2 | CH3OH | 341.41 | 17.050 | (51) |
| 5 | 8 | CH2 | CH2OH | 423.17 | CR | (36) |
| 5 | 9 | CH2 | CHOH | 517.64 | CR | (11) |
| 5 | 10 | CH2 | CH3COCH3 | 299.48 | 11.594 | (51) |
| 5 | 11 | CH2 | CH3CO | 431.49 | CR | (39) |
| 5 | 12 | CH2 | COO | 498.86 | CR | (8) |
| 5 | 13 | CH2 | aCH | 415.64 | CR | (51) |
| 5 | 14 | CH2 | aCCH3 | 569.18 | CR | (36) |
| 5 | 15 | CH2 | aCCH2 | 454.16 | CR | (51) |
| 5 | 16 | CH2 | H2O | 423.63 | 100.00 | (36) |
| 5 | 17 | CH2 | CO2 | 276.45 | CR | (90) |
| 6 | 6 | CH | CH | 95.621 | 8.0000 | (51) |
| 6 | 7 | CH | CH3OH | CR | CR | − |
| 6 | 8 | CH | CH2OH | 329.22 | CR | (37) |
| 6 | 9 | CH | CHOH | 0.0000 | CR | (11) |
| 6 | 10 | CH | CH3COCH3 | 637.29 | CR | (51) |
| 6 | 11 | CH | CH3CO | 321.91 | CR | (39) |
| 6 | 12 | CH | COO | 353.65 | CR | (37) |
| 6 | 13 | CH | aCH | 441.43 | CR | (51) |
| 6 | 14 | CH | aCCH3 | 769.36 | 8.0000 | (39) |
| 6 | 15 | CH | aCCH2 | 65.410 | CR | (51) |
| 6 | 16 | CH | H2O | 275.75 | CR | (37) |
| 6 | 17 | CH | CO2 | CR | CR | − |
| 7 | 7 | CH3OH | CH3OH | 307.69 | 19.235 | (51) |
| 7 | 8 | CH3OH | CH2OH | CR | CR | − |
| 7 | 9 | CH3OH | CHOH | CR | CR | − |
| 7 | 10 | CH3OH | CH3COCH3 | CR | CR | − |
| 7 | 11 | CH3OH | CH3CO | CR | CR | − |
| 7 | 12 | CH3OH | COO | CR | CR | − |
| 7 | 13 | CH3OH | aCH | 330.19 | CR | (39) |
| 7 | 14 | CH3OH | aCCH3 | 405.45 | CR | (39) |
| 7 | 15 | CH3OH | aCCH2 | CR | CR | − |
| 7 | 16 | CH3OH | H2O | 278.45 | CR | (51) |
| 7 | 17 | CH3OH | CO2 | 157.83 | 8.3462 | (90) |
| 8 | 8 | CH2OH | CH2OH | 407.22 | 22.699 | (36) |
| 8 | 9 | CH2OH | CHOH | 389.23 | CR | (11) |
| 8 | 10 | CH2OH | CH3COCH3 | 338.47 | CR | (11) |
| 8 | 11 | CH2OH | CH3CO | CR | CR | − |
| 8 | 12 | CH2OH | COO | CR | CR | − |
| 8 | 13 | CH2OH | aCH | 386.05 | CR | (37) |
| 8 | 14 | CH2OH | aCCH3 | 486.62 | CR | (37) |
| 8 | 15 | CH2OH | aCCH2 | 434.37 | CR | (37) |
| 8 | 16 | CH2OH | H2O | 353.37 | CR | (36) |
| 8 | 17 | CH2OH | CO2 | 312.30 | CR | (42) |
| 9 | 9 | CHOH | CHOH | 599.66 | 18.185 | (11) |
| 9 | 10 | CHOH | CH3COCH3 | 340.81 | CR | (11) |
| 9 | 11 | CHOH | CH3CO | CR | CR | − |
| 9 | 12 | CHOH | COO | CR | CR | − |
| 9 | 13 | CHOH | aCH | 512.16 | CR | (11) |
| 9 | 14 | CHOH | aCCH3 | 762.86 | CR | (11) |
| 9 | 15 | CHOH | aCCH2 | 357.91 | CR | (11) |
| 9 | 16 | CHOH | H2O | 479.16 | CR | (11) |
| 9 | 17 | CHOH | CO2 | CR | CR | − |
| 10 | 10 | CH3COCH3 | CH3COCH3 | 286.02 | 17.433 | (51) |
| 10 | 11 | CH3COCH3 | CH3CO | CR | CR | − |
| 10 | 12 | CH3COCH3 | COO | 547.44 | CR | (11) |
| 10 | 13 | CH3COCH3 | aCH | 333.11 | CR | (51) |
| 10 | 14 | CH3COCH3 | aCCH3 | 479.55 | 35.957 | (39) |
| 10 | 15 | CH3COCH3 | aCCH2 | 394.83 | CR | (51) |
| 10 | 16 | CH3COCH3 | H2O | 287.26 | CR | (51) |
| 10 | 17 | CH3COCH3 | CO2 | CR | CR | − |
| 11 | 11 | CH3CO | CH3CO | 525.22 | 19.050 | (39) |
| 11 | 12 | CH3CO | COO | CR | CR | |
| 11 | 13 | CH3CO | aCH | 426.72 | 18.030 | (39) |
| 11 | 14 | CH3CO | aCCH3 | 552.62 | 36.429 | (39) |
| 11 | 15 | CH3CO | aCCH2 | 663.71 | 30.712 | (39) |
| 11 | 16 | CH3CO | H2O | CR | CR | − |
| 11 | 17 | CH3CO | CO2 | CR | CR | − |
| 12 | 12 | COO | COO | 868.92 | 31.189 | (8) |
| 12 | 13 | COO | aCH | 534.18 | 22.088 | (39) |
| 12 | 14 | COO | aCCH3 | 595.48 | 15.874 | (39) |
| 12 | 15 | COO | aCCH2 | 265.62 | 9.3393 | (39) |
| 12 | 16 | COO | H2O | 396.81 | 15.140 | (91) |
| 12 | 17 | COO | CO2 | CR | CR | − |
| 13 | 13 | aCH | aCH | 371.53 | 14.756 | (51) |
| 13 | 14 | aCH | aCCH3 | 471.23 | CR | (90) |
| 13 | 15 | aCH | aCCH2 | 416.69 | CR | (51) |
| 13 | 16 | aCH | H2O | 357.78 | 38.640 | (51) |
| 13 | 17 | aCH | CO2 | CR | CR | − |
| 14 | 14 | aCCH3 | aCCH3 | 651.41 | 23.627 | (37,90) |
| 14 | 15 | aCCH3 | aCCH2 | CR | CR | − |
| 14 | 16 | aCCH3 | H2O | 360.70 | CR | (37) |
| 14 | 17 | aCCH3 | CO2 | CR | CR | − |
| 15 | 15 | aCCH2 | aCCH2 | 591.56 | 8.5433 | (51) |
| 15 | 16 | aCCH2 | H2O | 329.03 | CR | (37) |
| 15 | 17 | aCCH2 | CO2 | CR | CR | − |
| 16 | 16 | H2O | H2O | 266.68 | 17.020 | (9,10) |
| 16 | 17 | H2O | CO2 | 226.38 | CR | (90) |
| 17 | 17 | CO2 | CO2 | 207.89 | 26.408 | (90) |
The asterisk * indicates that the parameters are characterized in the current work.