Gas separation using graphene nanosheet: insights from theory and simulation

SM Fatemi, SJ Fatemi, Z Abbasi - Journal of Molecular Modeling, 2020 - Springer
The investigation of porous graphene, especially experimental research, is a challenging
issue in related academic and technology and has become a hot topic in recent years. It is …

Recent progress in gas separation using functionalized graphene nanopores and nanoporous graphene oxide membranes

F Malekian, H Ghafourian, K Zare, AA Sharif… - The European Physical …, 2019 - Springer
Carbon nanomaterials such as nanopores graphene, functionalized graphene and
graphene oxide membranes and so forth, have attracted much attention for not only scientific …

The change in the wetting regime of a nanodroplet on a substrate with varying wettability: A molecular dynamics investigation

M Foroutan, F Esmaeilian, MT Rad - Physics of Fluids, 2021 - pubs.aip.org
The effect of the triple-phase contact line (TPCL) on the wetting phenomenon has been
extensively discussed during the past decade. Numerous attempts have also been made to …

[HTML][HTML] Investigating the dynamic behavior of the nano-bubble in two-phase systems of argon and water: A molecular dynamics simulation approach

M Foroutan - Results in Engineering, 2023 - Elsevier
In this work, the dynamic behavior of the nano-bubble and the factors affecting its stability in
argon two-phase systems in the absence and presence of water have been investigated …

Wetting behavior of sessile droplet affected by chemical heterogeneity size: A theoretical and simulative analysis with consideration of contact line width

Y Wen, Y Liu - Chemical Engineering Science, 2022 - Elsevier
The effect of surface heterogeneity of solid substrate on the wetting behavior of sessile
droplets is systematically investigated. A theory is proposed to predict the contact angle by …

Wettability of Tetrahexcarbon: MD, DFT, and AIMD Approaches

MT Rad, M Foroutan - Langmuir, 2023 - ACS Publications
Graphene and its allotropes have attracted attention due to their special electronic,
mechanical, and thermal properties. Numerous studies investigate their wetting behavior …

Current investigations in theoretical studies of nanostructure–liquid interfaces

SM Fatemi, SJ Fatemi - Chinese Journal of Physics, 2020 - Elsevier
Wettability of surfaces is a significant factor affecting properties like water dispersion,
spreading, evaporation, dissociation and etc. Surface wettability and wetting behavior of a …

Triple-Phase Contact Line in Partial Wetting: Theories, Experimental Measurements, and Nanoscopic Approach

F Asjadi, F Esmaeilian, E Salahi - Journal of Advanced Materials and …, 2022 - jamt.ir
One of the overlooked topics in classical wetting, which is the main subject of numerous
recent researches, is the concept of the triple-phase contact line (TPCL). In this article, after …