Simulations of Nanoseparated Charged Surfaces Reveal Charge-Induced Water Reorientation and Nonadditivity of Hydration and Mean-Field Electrostatic Repulsion

We perform atomistic simulations of nanometer-separated charged surfaces in the presence of monovalent counterions at fixed water chemical potential. The counterion density profiles are well described by a modified Poisson-Boltzmann (MPB) approach that accounts for nonelectrostatic ion-surface inter...

Ausführliche Beschreibung

Bibliographische Detailangaben
Veröffentlicht in:Langmuir : the ACS journal of surfaces and colloids. - 1992. - 35(2019), 2 vom: 15. Jan., Seite 551-560
1. Verfasser: Schlaich, Alexander (VerfasserIn)
Weitere Verfasser: Dos Santos, Alexandre P, Netz, Roland R
Format: Online-Aufsatz
Sprache:English
Veröffentlicht: 2019
Zugriff auf das übergeordnete Werk:Langmuir : the ACS journal of surfaces and colloids
Schlagworte:Journal Article Research Support, Non-U.S. Gov't