Comparative molecular dynamics simulations of charged solid–liquid interfaces with different water models
Abstract
knowledge of the Stern layer charge is available. The findings could have significant implications for MD simulations of SLIs, especially at charged or electrified interfaces.
Fields of Study & Subjects
Electrostatics and Colloid Interactions
Spectroscopy and Quantum Chemical Studies
Nanopore and Nanochannel Transport Studies
Publication details
- Journal / source
- Physical Chemistry Chemical Physics
- Publisher
- Royal Society of Chemistry (RSC)
- Volume
- 28
- Issue
- 7
- Pages
- 4888–4899
- Publication date
- 1 January 2026
- Language
- EN