By Werner Freyland
Liquid Metals, Molten Salts, and Ionic beverages: a few simple homes -- Bulk Peculiarities: Metal-Nonmetal Transitions -- Interfacial part Transitions -- Electrified Ionic Liquid/Solid Interfaces
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Additional info for Coulombic Fluids: Bulk and Interfaces
As mentioned above, the experimental elucidation of the microscopic structure of room temperature ionic liquids employing diffraction methods is a complex problem and knowledge is rather limited. 58]. In general, a complete set of partial structure factors or distribution functions is not accessible. A specific complication in neutron scattering experiments is due to the large incoherent scattering cross section of hydrogen, which typically dominates the coherent contributions of other elements in the scattering function.
J. J. Stewart, Phil. Mag. 18. M. P. Tosi, Rep. Progr. Phys.
Computational modelling of ionic liquids includes methods such as classical MD and MC simulations, ab initio quantum chemical, and ab initio or Car–Parrinello MD calculations. A very recent review by Lynden-Bell et al. 45] covers results on ionic liquids obtained by these methods. So, we concentrate here on a few topics of these computations on the structural properties. They have been performed predominantly for imidazolium-based ionic liquids and their mixtures. 46]. 29) – but without the quadrupolar term.
Coulombic Fluids: Bulk and Interfaces by Werner Freyland