Structural Features of Triethylammonium Acetate through Molecular Dynamics.

Although the simulations presented here were unable to reach equilibrium owing to the relatively high computational cost, it was possible to trace a clear trend that is compatible with the experimental findings and, in particular, I have found the following: (i) starting from a completely neutral system, only a limited proton migration from the acetic acid toward the triethylamine is seen and the formation of the triethylammonium acetate ionic liquid occur

also in 19,460 other papers