Hydrogen Isotope Effects on Aqueous Electrolyte for Electrochemical Lithium‐Ion Storage

J Chou, Y Zhao, XT Li, WP Wang, SJ Tan… - Angewandte …, 2022 - Wiley Online Library
As two stable hydrogen isotopes, protium and deuterium show magnified isotope effects in
physicochemical properties due to the significantly varied atomic masses. In this work …

Correlated interfacial water transport and proton conductivity in perfluorosulfonic acid membranes

X Ling, M Bonn, KF Domke… - Proceedings of the …, 2019 - National Acad Sciences
Water must be effectively transported and is also essential for maximizing proton
conductivity within fuel-cell proton-exchange membranes (PEMs). Therefore, identifying …

A predictive model for self-, Maxwell-Stefan, and Fick diffusion coefficients of binary supercritical water mixtures

X Zhao, T Luo, H ** - Journal of Molecular Liquids, 2021 - Elsevier
Abstract Self-, Maxwell-Stefan, and Fick diffusion coefficients of binary supercritical water
mixtures (species 1: H 2 O, species 2: H 2, CH 4, CO, O 2, CO 2) at 673-973 K and 250 atm …

Temperature dependence of diffusion coefficient of carbon monoxide in water: A molecular dynamics study

I Poudyal, NP Adhikari - Journal of Molecular Liquids, 2014 - Elsevier
In the present work, molecular dynamics simulations of a mixture of carbon monoxide (CO)
gas in SPC/E water (H 2 O) with CO as a solute and water as a solvent have been performed …

Rotational and translational dynamics of the SPC/E water model

N Meyer, V Piquet, JF Wax, H Xu, C Millot - Journal of Molecular Liquids, 2019 - Elsevier
Translational and rotational diffusion coefficients and the translation-rotation couplings of the
SPC/E water model are investigated in liquid phase by molecular dynamics simulations in …

Adsorption Mechanism of Benzene Derivatives by Pagoda[n]arenes

Z **, Z Yang, X Zhang, H Yuan, W Wang… - …, 2023 - Wiley Online Library
Despite the widespread use in industrial production, benzene derivatives are harmful to both
human beings and the environment. The control of these substances has become an …

Simulation of experimental synthetic DNA tracer transport through the vadose zone

C Wang, G Liu, CP McNew, THM Volkmann, L Pangle… - Water Research, 2022 - Elsevier
Although multiple experimental studies have proven the use of free synthetic DNA as tracers
in hydrological systems, their quantitative fate and transport, especially through the vadose …

Optimization of the Urea Removal in a Wearable Dialysis Device Using Nitrogen-Doped and Phosphorus-Doped Graphene

K Karimi, M Rahsepar - ACS omega, 2022 - ACS Publications
Dialysis has been recognized as an essential treatment for end-stage renal disease (ESRD).
This therapy, however, suffers from several limitations leading to numerous complications in …

[HTML][HTML] The role of diffusion in the hydrolytic degradation of poly (lactic-co-glycolic acid): A molecular perspective

Q Zhang, M Heuchel, AF Thüneman… - Polymer Degradation and …, 2025 - Elsevier
This research emphasizes the importance of internal surface erosion as a key factor in the
hydrolytic degradation of PLGA (poly (D, L-lactic-co-glycolic acid)) providing an alternative …

Quantitative prediction of dynamic HTO migration behavior in the soil and non-negligible evapotranspiration effect

B Nie, S Wu, D Yang, D Chen, W Gu, W Zhou… - Journal of Hazardous …, 2022 - Elsevier
Tritium is mainly produced from nuclear facilities apart from nuclear tests. After being
released to the environment, tritium would cause water & food contamination due to its …