Full metadata record
DC Field | Value | Language |
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dc.citation.title | SCIENTIFIC REPORTS | - |
dc.citation.volume | 8 | - |
dc.contributor.author | Lee, Ji Hye | - |
dc.contributor.author | Doo, Gisu | - |
dc.contributor.author | Kwon, Sung Hyun | - |
dc.contributor.author | Choi, Sungyu | - |
dc.contributor.author | Kim, Hee-Tak | - |
dc.contributor.author | Lee, Seung Geol | - |
dc.date.accessioned | 2024-03-26T14:05:10Z | - |
dc.date.available | 2024-03-26T14:05:10Z | - |
dc.date.created | 2024-03-26 | - |
dc.date.issued | 2018-07 | - |
dc.description.abstract | In this study, we examined the influence of the dispersion solvent in three dipropylene-glycol/ water (DPG/water) mixtures, with DPG contents of 0, 50, and 100 wt%, on ionomer morphology and distribution, using dynamic light scattering (DLS) and molecular-dynamics (MD) simulation techniques. The DLS results reveal that Nafion-ionomer aggregation increases with decreasing DPG content of the solvent. Increasing the proportion of water in the solvent also led to a gradual decrease in the radius of gyration (R-g) of the Nafion ionomer due to its strong backbone hydrophobicity. Correspondingly, MD simulations predict Nafion-ionomer solvation energies of - 147 +/- 9 kcal/mol in water, - 216 +/- 21 kcal/ mol in the DPG/water mixture, and - 444 +/- 9 kcal/mol in DPG. These results suggest that higher water contents in mixed DPG/water solvents result in increased Nafion-ionomer aggregation and the subsequent deterioration of its uniform dispersion in the solvent. Moreover, radial distribution functions (RDFs) reveal that the (-CF2CF2-) backbones of the Nafion ionomer are primarily enclosed by DPG molecules, whereas the sulfonate groups (SO3 (-)) of its side chains mostly interact with water molecules. | - |
dc.identifier.bibliographicCitation | SCIENTIFIC REPORTS, v.8 | - |
dc.identifier.doi | 10.1038/s41598-018-28779-y | - |
dc.identifier.issn | 2045-2322 | - |
dc.identifier.scopusid | 2-s2.0-85050406464 | - |
dc.identifier.uri | https://scholarworks.unist.ac.kr/handle/201301/81844 | - |
dc.identifier.wosid | 000438679100044 | - |
dc.language | 영어 | - |
dc.publisher | NATURE PUBLISHING GROUP | - |
dc.title | Dispersion-Solvent Control of Ionomer Aggregation in a Polymer Electrolyte Membrane Fuel Cell | - |
dc.type | Article | - |
dc.description.isOpenAccess | TRUE | - |
dc.relation.journalWebOfScienceCategory | Multidisciplinary Sciences | - |
dc.relation.journalResearchArea | Science & Technology - Other Topics | - |
dc.type.docType | Article | - |
dc.description.journalRegisteredClass | scie | - |
dc.description.journalRegisteredClass | scopus | - |
dc.subject.keywordPlus | NEUTRON-SCATTERING | - |
dc.subject.keywordPlus | SWOLLEN MEMBRANES | - |
dc.subject.keywordPlus | ORGANIC-SOLVENTS | - |
dc.subject.keywordPlus | FORCE-FIELD | - |
dc.subject.keywordPlus | ANGLE X-RAY | - |
dc.subject.keywordPlus | MOLECULAR-DYNAMICS SIMULATION | - |
dc.subject.keywordPlus | SPIN-RESONANCE SPECTRA | - |
dc.subject.keywordPlus | NAFION MEMBRANES | - |
dc.subject.keywordPlus | CATALYST LAYERS | - |
dc.subject.keywordPlus | PERFLUOROSULFONATED IONOMERS | - |
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