Elucidating the impact mechanism of temperature and water content on thermal conductivity of hydrated Nafion membranes by molecular dynamics simulation

L Xian, Z Li, S Li, L Chen, WQ Tao - International Journal of Heat and Mass …, 2023 - Elsevier
The thermal conductivity of the proton exchange membrane significantly affects the
operating performance of the fuel cell. In this work, the impact of water content and …

Influence on the adsorption of phenol on single-walled carbon nanotubes caused by NaCl and an electrostatic field in saline

Y Han, Q Zhang, L Wu - Desalination, 2020 - Elsevier
In the present study, the molecular dynamics simulation method was used to investigate the
influence on the adsorption capacity of single-walled carbon nanotubes (SWCNTs) to …

Dynamics of water-induced surface reorganization in poly (methyl methacrylate) films

A Horinouchi, H Atarashi, Y Fujii, K Tanaka - Macromolecules, 2012 - ACS Publications
At the outermost surface, aggregation states of polymers generally tend to alter to their most
stable ones in response to their surrounding environment. We here apply a time-resolved …

Light‐Operated Transient Unilateral Adhesive Hydrogel for Comprehensive Prevention of Postoperative Adhesions

F Cui, S Shen, X Ma, D Fan - Advanced Science, 2024 - Wiley Online Library
Dislocation of anti‐adhesion materials, non‐specific tissue adhesion, and the induction of
secondary fibrinolysis disorders are the main challenges faced by postoperative anti …

Structure and hydrogen bonding of water in polyacrylate gels: effects of polymer hydrophilicity and water concentration

S Mani, F Khabaz, RV Godbole… - The Journal of …, 2015 - ACS Publications
The ability to tune the hydrophilicity of polyacrylate copolymers by altering their composition
makes these materials attractive candidates for membranes used to separate alcohol–water …

In-situ desorption of acetaminophen from the surface of graphene oxide driven by an electric field: A study by molecular dynamics simulation

Y Han, S Ma, J Ma, P Guiraud, X Guo, Y Zhang… - Chemical Engineering …, 2021 - Elsevier
In the present study, molecular dynamics (MD) simulation was performed to study the effect
of electric field on the adsorption characteristics of acetaminophen (APAP) on graphene …

Polystyrene nanoparticles as a flotation collector: A molecular dynamics study

A Mabudi, M Noaparast, M Gharabaghi… - Journal of Molecular …, 2019 - Elsevier
Nanoparticles have significant potential as new candidates for generating new types of
flotation reagents with unique performance for wettability design and control. Hence, this …

Adhesion and friction properties of polymer brushes: fluoro versus nonfluoro polymer brushes at varying thickness

NS Bhairamadgi, SP Pujari, FAM Leermakers… - Langmuir, 2014 - ACS Publications
A series of different thicknesses of fluoro poly (2, 2, 2-trifluoroethyl methacrylate) and its
analogous nonfluoro poly (ethyl methacrylate) polymer brushes were prepared via surface …

Effect of side-chain carbonyl groups on the interface of vinyl polymers with water

Y Oda, A Horinouchi, D Kawaguchi, H Matsuno… - Langmuir, 2014 - ACS Publications
The nature of the polymer–water interface in the poly (methyl 2-propenyl ether)(PMPE)–
water model system is investigated by sum-frequency generation spectroscopy, which at the …

Tunable anion exchange membrane conductivity and permselectivity via non-covalent, hydrogen bond cross-linking

R Kingsbury, M Hegde, J Wang… - … applied materials & …, 2021 - ACS Publications
Ion exchange membranes (IEMs) are a key component of electrochemical processes that
purify water, generate clean energy, and treat waste. Most conventional polymer IEMs are …