Table 6. Contributions of ⟨M⃗Dperm(0)·M⃗D(t)⟩, ⟨M⃗Dind(0)·M⃗D(t)⟩, and ⟨M⃗Dperm(0)·M⃗D(t)⟩ to the Static Dielectric Permittivity ϵ(0) Obtained from a Polarizable MD Simulation of [C2mim][OTf]138,a.
| C2mim |
OTf |
||||
|---|---|---|---|---|---|
| permanent | induced | permanent | induced | ||
| C2mim | permanent | 0.82 (0.69) | 0.03 | 0.18 (0.30) | 0.04 |
| induced | 0.03 | 0.11 | 0.36 | 0.00 | |
| OTf | permanent | 0.18 (0.30) | 0.36 | 6.53 (6.46) | –0.15 |
| induced | 0.04 | 0.00 | –0.15 | 0.03 | |
a
The number in brackets represent the contributions in a nonpolarizable simulation of the otherwise same force field.