Movement of uncharged particles in the electrostatic field Electrophoretic mobility of oil • Oil droplets in pure water show different mobilities depending on the pH • Attributed to the adsorption of 𝑂𝐻− or 𝐻3 𝑂+ surface charge • Point of zero charge is at pH=6, but at that point there is negative mobility 𝐸 + If pH is neutral or high If pH is low + ++ + + + ++ + + + + + + + + + + + + + Electrophoretic mobility of oil • Heptane droplet/slab in water • Hydropobic wall in water • Complete absence of ions • Electric field Electrophoretic mobility of oil • Oil droplets migrate in the negative field direction • Slab moves tangential to the interface • Electrostatic potential of oil phase? positive 𝐸 + - 𝐸 Electrophoretic mobility of oil • Mobility contributions: electrophoretical force + frictional force • Interface roughness is required for electrophoretic force Electrophoretic mobility of oil - Conclusions • Mobility in the absence of ions should be zero, but simulations show negative mobility • Electrophoresis does not only reflect charge or electrophoretic potential of the droplet • Mobility is attributed to partial charges of the atoms • If true, electrophoretic experiments could me misleading Electrophoretic mobility of oil - Explanation • Mobility only appears when using simple truncation method for LJ forces. Water flow on carbon nanotubes • Water oriented along one direction by aplying an external field • Flux in the direction of the aligned water dipoles Water flow on carbon nanotubes • When using shift approach instead of truncated forces for LJ, mobilities dissapear. • In LAMMPS, flux dissapears for smaller rc