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Water Transport through Nanotubes with Varying Interaction Strength between Tube Wall and Water
We present the results from extensive molecular dynamics simulations to study the effect of varying interaction strength, ε(NT–OW), between the nanotube atoms and water’s oxygen atom. We find the existence of a narrow transition region (ε(NT–OW) ≈ 0.05 - 0.075 kcal/mol) in which water occupancy with...
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| Publicado no: | J Phys Chem Lett |
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| Main Authors: | , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
2011
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4297660/ https://ncbi.nlm.nih.gov/pubmed/25606067 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jz2012319 |
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