Molecular Modeling of Aqueous Solutions at Substrate-Solution Interfaces and in Nano-Confinement

Graduate student and postdoctoral research positions are periodically open in the area of classical and quantum computer simulations of the properties of aqueous solutions over a wide range of thermodynamic conditions, at interfaces and in nano-confinement of these solutions with various substrates: minerals, polymer membranes, activated carbon, natural organic matter.

Molecular mechanisms of the following processes are investigated:

hydrogen bonding hydration ion pairing proton transfer

adsorption intercalation diffusion phase separation

Experience and interest in using inelastic and quasielastic neutron scattering to study the same systems and processes can be an additional asset.

Informal inquiries should be sent to .