Wettability of Two-Dimensional Carbon Allotropes from Molecular Simulations
Force-field Monte Carlo and Molecular Dynamics simulations are used to compare wetting behaviors of model carbon sheets mimicking neat graphene, its saturated derivative, graphane, and related planar allotropes penta-graphene, <i>γ</i>-graphyne, and <i>ψ</i>-graphene in conta...
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| Main Authors: | Margaret E. Thornton, Serban G. Zamfir, Dusan Bratko |
|---|---|
| Format: | Article |
| Language: | English |
| Published: |
MDPI AG
2025-08-01
|
| Series: | Molecules |
| Subjects: | |
| Online Access: | https://www.mdpi.com/1420-3049/30/15/3296 |
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