Litcius/Paper detail

Theory of Charge Regulation of Colloidal Particles in Electrolyte Solutions

Amin Bakhshandeh, Derek Frydel, Yan Levin

2022Langmuir25 citationsDOI

Abstract

We present a theory that enables us to (i) calculate the effective surface charge of colloidal particles and (ii) efficiently obtain titration curves for different salt concentrations. The theory accounts for the shift of pH of solution due to the presence of 1:1 electrolyte. It also accounts self-consistently for the electrostatic potential produced by the deprotonated surface groups. To examine the accuracy of the theory, we have performed extensive reactive Monte Carlo simulations, which show excellent agreement between theory and simulations without any adjustable parameters.

Topics & Concepts

ElectrolyteMonte Carlo methodSurface chargeColloidCharge (physics)ElectrostaticsColloidal particleChemical physicsChemistryTitrationSalt (chemistry)ThermodynamicsStatistical physicsMaterials scienceInorganic chemistryPhysical chemistryPhysicsElectrodeQuantum mechanicsMathematicsStatisticsElectrostatics and Colloid InteractionsIron oxide chemistry and applicationsSpectroscopy and Quantum Chemical Studies