Confined water: structure, dynamics, and thermodynamics
Conspectus Understanding the properties of strongly confined water is important for a
variety of applications such as fast flow and desalination devices, voltage generation, flow …
variety of applications such as fast flow and desalination devices, voltage generation, flow …
Molecular simulation of water in carbon nanotubes
A Alexiadis, S Kassinos - Chemical reviews, 2008 - ACS Publications
According to Monthioux and Kuznetsov, 1 the first mention of carbon filaments was reported
in 18892 in a patent proposing the use of such filaments in light bulbs (interestingly enough …
in 18892 in a patent proposing the use of such filaments in light bulbs (interestingly enough …
Wettability effect on nanoconfined water flow
Understanding and controlling the flow of water confined in nanopores has tremendous
implications in theoretical studies and industrial applications. Here, we propose a simple …
implications in theoretical studies and industrial applications. Here, we propose a simple …
Current understanding of water properties inside carbon nanotubes
A Chatzichristos, J Hassan - Nanomaterials, 2022 - mdpi.com
Confined water inside carbon nanotubes (CNTs) has attracted a lot of attention in recent
years, amassing as a result a very large number of dedicated studies, both theoretical and …
years, amassing as a result a very large number of dedicated studies, both theoretical and …
Molecular dynamics study of nanoconfined TIP4P/2005 water: how confinement and temperature affect diffusion and viscosity
A Zaragoza, MA González, L Joly… - Physical Chemistry …, 2019 - pubs.rsc.org
In the past few decades great effort has been devoted to the study of water confined in
hydrophobic geometries at the nanoscale (tubes and slit pores) due to the multiple …
hydrophobic geometries at the nanoscale (tubes and slit pores) due to the multiple …
The role of activation energy and reduced viscosity on the enhancement of water flow through carbon nanotubes
JS Babu, SP Sathian - The Journal of chemical physics, 2011 - pubs.aip.org
Molecular dynamics simulations are carried out to study the pressure driven fluid flow of
water through single walled carbon nanotubes. A method for the calculation of viscosity of …
water through single walled carbon nanotubes. A method for the calculation of viscosity of …
Nanoscale carbon greatly enhances mobility of a highly viscous ionic liquid
VV Chaban, OV Prezhdo - ACS nano, 2014 - ACS Publications
The ability to encapsulate molecules is one of the outstanding features of nanotubes. The
encapsulation alters physical and chemical properties of both nanotubes and guest species …
encapsulation alters physical and chemical properties of both nanotubes and guest species …
Carbon nanotube: possible candidate for forward osmosis
Y Jia, H Li, M Wang, L Wu, Y Hu - Separation and Purification Technology, 2010 - Elsevier
In this study, the transport phenomena of water molecules and ions through the membranes
incorporating the neutral “armchair”(R, R) carbon nanotubes (CNTs) with indices R= 6–11 …
incorporating the neutral “armchair”(R, R) carbon nanotubes (CNTs) with indices R= 6–11 …
Simulations of water transport through carbon nanotubes: how different water models influence the conduction rate
The conduction rate of water through (8, 8) and (9, 9) carbon nanotubes at 300 K and a
pressure difference of 220 MPa is investigated using molecular dynamics simulations. The …
pressure difference of 220 MPa is investigated using molecular dynamics simulations. The …
An investigation of the density of nano-confined subcritical/supercritical water
B Zhang, X Zhao, J Zhang, J Wang, H Jin - Energy, 2023 - Elsevier
In various applications such as supercritical water gasification, oil and gas production, and
energy harvesting and storage, subcritical/supercritical water is often confined within …
energy harvesting and storage, subcritical/supercritical water is often confined within …