Experimental (exp), simulated (sim), and theoretically estimated (es) transport properties reported in literature for the ILs studied in this work at 300 Ka.
| IL | Shear viscosity, η [cP] | Self-diffusion coefficient, Dib [10−7 cm2 s−1] | Thermal conductivity, λ [W m−1 K−1] | ||||
|---|---|---|---|---|---|---|---|
| exp | sim | exp | sim | exp | sim | es | |
| [C4mim][PF6] | 224.74 (ref. 44) | 264.4 (ref. 13)b | 6.17/5.26 (ref. 44)c | 4.7/3.2 (ref. 29)d | 0.145 (ref. 50) | N/A | 0.147 (ref. 53) |
| 228.81 (ref. 46) | 39 (ref. 29)d | 6.43/5.14 (ref. 45)c | 0.145 (ref. 51) | ||||
| 257.36 (ref. 46) | 31.3 (ref. 49)e | 0.173 (ref. 52) | |||||
| 450 (ref. 47) | 231.3 (ref. 49)e | ||||||
| 25.51 (ref. 44)c | |||||||
| 27.08 (ref. 48)c | |||||||
| 32.33 (ref. 46)c | |||||||
| [C4mim][BF4] | 90.61 (ref. 44) | 97.8 (ref. 13)b | 10.21/10.2 (ref. 44)c | 9.7/8.2 (ref. 29)d | 0.169 (ref. 54) | N/A | 0.167 (ref. 53) |
| 86.8 (ref. 46) | 111.2 (ref. 31)b | 9.69/10.1 (ref. 45)c | 0.186 (ref. 55) | ||||
| 107.32 (ref. 48) | 0.190 (ref. 52) | ||||||
| 219 (ref. 47)f | |||||||
| [C4mim][OMs] | 31.25 (ref. 56)g | N/A | 5.48/4.89 (ref. 56)g | N/A | N/A | N/A | 0.171 (ref. 53) |
| [C4mim][NTf2] | 46.24 (ref. 44) | 537.8 (ref. 59) | 14.06/11.23 (ref. 44)c | 4.91/3.35 (ref. 59)c | 0.126 (ref. 59)f | 0.107 (ref. 59) | 0.123 (ref. 53) |
| 46.5 (ref. 46) | 45 (ref. 11)f | 13.80/11.68 (ref. 45)c | 10.9/7.8 (ref. 29)d | 0.127 (ref. 61) | |||
| 46.44 (ref. 57) | 72.09 (ref. 60)f | ||||||
| 46.79 (ref. 58) | 49.9 (ref. 13)b | ||||||
| 69 (ref. 47)f | |||||||
| [C4mim][CF3COO] | 63.2 (ref. 62) | N/A | 11.18/10.23 (ref. 44)c | 19.8/17.2 (ref. 29)d | N/A | N/A | 0.166 (ref. 53) |
| 70.02 (ref. 44) | 11.1/9.76 (ref. 45)c | ||||||
| [C4mim][Br] | 200 (ref. 63) | 231.1 (ref. 13)b | 2./N/A (ref. 66)c | 22/21.08 (ref. 68)e | N/A | N/A | 0.159 (ref. 53) |
| 230 (ref. 63)b | 19.8/N/A (ref. 67)d | ||||||
| 161.05 (ref. 64)b,h | 9.1/N/A (ref. 68)i | ||||||
| 1486.49 (ref. 65)b | |||||||
Cation/anion.
At 298 K.
At 350 K.
At 353 K.
At 360 K.
At 298.15 K.
At 358.15 K.
At 5.74 mol L−1 IL concentration in aqueous solution.
At 358 K.