The interplay between crystal and solvent structure, interparticle forces and ensemble particle response dynamics governs the process of crystallization by oriented attachment …
A crucial determinant of Hofmeister effects is the direct interaction of ions in solution with the charged groups on the surface of larger particles. Understanding ion–ion interactions in …
Water mediates electrostatic interactions via the orientation of its dipoles around ions, molecules, and interfaces. This induced water polarization consequently influences multiple …
Y Li, M Girard, M Shen, JA Millan… - Proceedings of the …, 2017 - National Acad Sciences
Controlling interactions between proteins and nanoparticles in electrolyte solutions is crucial for advancing biological sciences and biotechnology. The assembly of charged …
Y Jing, V Jadhao, JW Zwanikken… - The Journal of chemical …, 2015 - pubs.aip.org
The behavior of ions in liquids confined between macromolecules determines the outcome of many nanoscale assembly processes in synthetic and biological materials such as …
METHOD The idea of the present method is to consider the electrostatic potential produced by the plates as an external scalar field acting on all the ions inside the simulation cell. As …
We study, using Density Functional theory (DFT) and Monte Carlo simulations, aqueous electrolyte solutions between charged infinite planar surfaces, in contact with a bulk salt …
D Bagchi, TD Nguyen… - Proceedings of the …, 2020 - National Acad Sciences
Understanding nanoscale interactions at the interface between two media with different dielectric constants is crucial for controlling many environmental and biological processes …
We use molecular dynamics simulations of the primitive model of electrolytes to study the ionic structure in aqueous monovalent electrolyte solutions confined by charged planar …