Water at charged interfaces

G Gonella, EHG Backus, Y Nagata… - Nature Reviews …, 2021 - nature.com
The ubiquity of aqueous solutions in contact with charged surfaces and the realization that
the molecular-level details of water–surface interactions often determine interfacial functions …

Confinement-controlled aqueous chemistry within nanometric slit pores: Focus review

D Munoz-Santiburcio, D Marx - Chemical Reviews, 2021 - ACS Publications
In this Focus Review, we put the spotlight on very recent insights into the fascinating world of
wet chemistry in the realm offered by nanoconfinement of water in mechanically rather rigid …

Multiscale modeling of aqueous electric double layers

M Becker, P Loche, M Rezaei, A Wolde-Kidan… - Chemical …, 2023 - ACS Publications
From the stability of colloidal suspensions to the charging of electrodes, electric double
layers play a pivotal role in aqueous systems. The interactions between interfaces, water …

Confined water's dielectric constant reduction is due to the surrounding low dielectric media and not to interfacial molecular ordering

JF Olivieri, JT Hynes, D Laage - The Journal of Physical Chemistry …, 2021 - ACS Publications
Liquid water confined within nanometer-sized channels exhibits a surprisingly low dielectric
constant along the direction orthogonal to the channel walls. This is typically assumed to …

Universal reduction in dielectric response of confined fluids

MH Motevaselian, NR Aluru - ACS nano, 2020 - ACS Publications
Dielectric permittivity is central to many biological and physiochemical systems, as it affects
the long-range electrostatic interactions. Similar to many fluid properties, confinement …

Universal and nonuniversal aspects of electrostatics in aqueous nanoconfinement

P Loche, C Ayaz, A Wolde-Kidan… - The Journal of …, 2020 - ACS Publications
Dielectric water properties, which significantly change in confinement, determine
electrostatic interactions and thereby influence all molecular forces and chemical reactions …

Finding Infinities in Nanoconfined Geothermal Electrolyte Static Dielectric Properties and Implications on Ion Adsorption/Pairing

K Leung - Nano Letters, 2023 - ACS Publications
Infinities should naturally occur in the dielectric responses of ionic solutions relevant to many
geochemical, energy storage, and electrochemical applications at a strictly zero frequency …

Dielectric properties of nanoconfined water: A canonical thermopotentiostat approach

F Deißenbeck, C Freysoldt, M Todorova… - Physical Review Letters, 2021 - APS
We introduce a novel approach to sample the canonical ensemble at constant temperature
and applied electric potential. Our approach can be straightforwardly implemented into any …

Dielectric Properties of Nanoconfined Water from Ab Initio Thermopotentiostat Molecular Dynamics

F Deißenbeck, S Wippermann - Journal of Chemical Theory and …, 2023 - ACS Publications
We discuss how to include our recently proposed thermopotentiostat technique
[Deissenbeck et al. Phys. Rev. Lett. 2021, 126, 136803] into any existing ab initio molecular …

Dielectric susceptibility of water in the interface

DV Matyushov - The Journal of Physical Chemistry B, 2021 - ACS Publications
It has long been anticipated that dielectric constants of polar liquids are reduced in the
interfacial layer. Recent experiments and computer simulations support these expectations …