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. Author manuscript; available in PMC: 2022 Nov 14.
Published in final edited form as: Phys Chem Chem Phys. 2012 Jan 27;14(9):3089–3102. doi: 10.1039/c2cp23329k

Table I.

Fit of the rotational relaxation constants, T+ and T diffusion coefficients, D+ and D-, as well as the static conductivity σ(0) with a logistic function in Eq. (21) as a function of degree of polarizability.

T+, T A0 [ns] A [ns] k α0 [%]
polarizable EMIM+ 7.81 -6.06 0.030 0.0
polarizable OTf 1.74 -1.06 0.030 0.0
charge-scaled EMIM+ 9.13 -8.79 0.030 0.0
charge-scaled OTf 1.22 -0.98 0.093 62.2
D+,D A0 / 10–7 cm2 s A / 10–7 cm2 s k α0 [%]
polarizable EMIM+ 0.259 0.62 0.030 89.3
polarizable OTf 0.111 0.38 0.030 89.3
charge-scaled EMIM+ 0.260 9.36 0.030 156.3
charge-scaled OTf 0.072 5.12 0.030 156.3
σ(0) A0 / S m–1 A / S m–1 k α0 [%]
polarizable 0.069 0.160 0.030 89.3
charge-scaled a 0.084 0.896 0.030 156.3
charge-scaled 0.055 0.896 0.030 116.6
a

The collective translational dipole moment MJ(t) was not scaled by (Seff)–1 in the analysis of the dipolar mean-squared displacement corresponding to Eq. (15).