[HTML][HTML] Insights into the morphology and gas separation characteristics of methylene diisocyanate (MDI)-functionalized nanoTiO2 polyurethane: quantum mechanics …
I Salahshoori, MN Jorabchi, M Asghari… - Journal of Materials …, 2023 - Elsevier
It is of important scientific significance to develop membranes with high gas transfer
properties. The primary aim of our study was to inspect the gas separation behavior and …
properties. The primary aim of our study was to inspect the gas separation behavior and …
Roles of functionalized nanoparticles in the performance improvement of proton-exchange membranes used in low-and intermediate-temperature hydrogen fuel cells …
A variety of nanoparticles (NPs)(eg, SiO 2, TiO 2, CeO 2, Co 3 O 4, etc.) and their
functionalized counterparts have been intensively investigated for improving the …
functionalized counterparts have been intensively investigated for improving the …
[HTML][HTML] Non-ionic deep eutectic solvents for membrane formation
Deep eutectic solvents (DES) have recently emerged as a new class of inexpensive
biodegradable solvents and additives with diverse applications. In this study, a new family of …
biodegradable solvents and additives with diverse applications. In this study, a new family of …
Study of the physicochemical and transport performance of neat Matrimid 5218 membrane with nanoparticles: A molecular dynamics simulation
S Rashidian, MO Nasrin, MZ Pedram… - … Analysis with Boundary …, 2023 - Elsevier
Our study employed Molecular dynamics (MD) simulations using BIOVIA Materials Studio
2021 software programs to analyze neat and mixed matrix membranes (MMMs) for their …
2021 software programs to analyze neat and mixed matrix membranes (MMMs) for their …
Combined experimental and molecular simulation study of arginine/PBI composite membranes for high-temperature fuel cells
D Zhang, X Yu, F Zhang, W Liu, J Miao, X Li - Journal of Materials Science, 2023 - Springer
High-temperature proton exchange membranes (HTPEMs) based on arginine-modified
phosphoric acid-doped polybenzimidazole (Arginine-PBI-PA) and poly (tetrafluoroethylene) …
phosphoric acid-doped polybenzimidazole (Arginine-PBI-PA) and poly (tetrafluoroethylene) …
The effect of the molecular weight and polydispersity index on the thermal conductivity of polyamide 6: a molecular dynamics study
N Ghahramani, M Rahmati - International Journal of Heat and Mass …, 2020 - Elsevier
In this study, the influence of both molecular weight (expressed as the degree of
polymerization (DOP)) and Polydispersity index (PDI) on the thermal conductivity of …
polymerization (DOP)) and Polydispersity index (PDI) on the thermal conductivity of …
Quantifying proton diffusion in acid-functionalized chitosan membranes
G Bazargan, SA Fischer, D Gunlycke - Computational Materials Science, 2022 - Elsevier
We explore proton diffusion in hydrated, maleic-acid-functionalized chitosan membranes
using ab initio molecular dynamics (AIMD) simulations. Our simulations show that more …
using ab initio molecular dynamics (AIMD) simulations. Our simulations show that more …
Influence of different configurations of Fe nanoparticles on the melting point: a molecular dynamics simulation
M Wu, X Zhang, F Ma, S Dong, W Yang… - Bulletin of Materials …, 2021 - Springer
Molecular dynamics simulation is used to explore the changes in melting point of Fe
nanomaterials under different initial configurations. What reveals in this simulation is that an …
nanomaterials under different initial configurations. What reveals in this simulation is that an …
[HTML][HTML] BaCe0.8Al0.2O3掺杂的SPEEK复合质子交换膜制备与性能
王颖锋， 江坤， 张琳琳， 刘运权， 李水荣， 王夺… - 高校化学工程 …, 2021 - xml-data.org
针对普通磺化聚醚醚酮(SPEEK) 膜质子传导率较低的问题, 提出无机掺杂的改善方法.
采用共沉淀法制备BaCe 0.8 Al 0.2 O 3 复合氧化物, 将其掺杂到SPEEK 膜基体中 …
采用共沉淀法制备BaCe 0.8 Al 0.2 O 3 复合氧化物, 将其掺杂到SPEEK 膜基体中 …
Simulation and optimization of direct glucose fuel cell
K Kaewsongpol, S Changkhamchom… - Journal of Renewable …, 2021 - pubs.aip.org
This work develops an unsteady state, nonisothermal, and three-dimensional model of the
anion exchange membrane direct glucose fuel cell (AEM-DGFC). The model includes heat …
anion exchange membrane direct glucose fuel cell (AEM-DGFC). The model includes heat …