Molecular Dynamics Simulations of Nanoscale Friction on Illite Clay: Effects of Solvent Salt Ions and Electric Double Layer
This file is associated with the article "Molecular Dynamics Simulations of Nanoscale Friction on Illite Clay: Effects of Solvent Salt Ions and Electric Double Layer." It provides the coordinate and topology files used in the molecular dynamics simulations for two systems described in the study. System I: A model simulating the sliding of an illite particle against an infinite illite surface. System II: A model consisting of an infinite illite surface for studying surrounding electric double layers. Both systems correspond directly to those analyzed in the article.
Institutions
- Norwegian University of Science and Technology (NO)
Publication Details
- Journal
- Zenodo (CERN European Organization for Nuclear Research)
- Published
- 2025-08-28
- DOI
- https://doi.org/10.5281/zenodo.16983724
- Primary Topic
- Geochemistry and Geologic Mapping
- Type
- article
- Field-Weighted Citation Impact
- 0.00