Supplement Number 1
Abstract
Histograms of the umbrella sampling simulations of all 3 nanotube models, including Figure S1-S3. Comparison between the direction of the electric field: perpendicular and parallel the CNT on nanotube model #2, Figure S4. Repeated simulations with TIP4P water model, Figure S5-S9, Table S1.
Fields of Study & Subjects
Nanopore and Nanochannel Transport Studies
Electrostatics and Colloid Interactions
Advanced Physical and Chemical Molecular Interactions
Publication details
- Journal / source
- AIP Publishing
- Publication date
- 1 January 2026
- Language
- EN