Polymer design for solvent separations by integrating simulations, experiments and known physics via machine learning
Abstract This study guides the discovery of sustainable high-performance polymer membranes for organic binary solvent separations. We focus on solvent diffusivity in polymers, a key factor in quantifying solvent transport. Traditional experimental and computational methods for determining diffusivit...
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| Main Authors: | Janhavi Nistane, Rohan Datta, Young Joo Lee, Harikrishna Sahu, Seung Soon Jang, Ryan Lively, Rampi Ramprasad |
|---|---|
| Format: | Article |
| Language: | English |
| Published: |
Nature Portfolio
2025-06-01
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| Series: | npj Computational Materials |
| Online Access: | https://doi.org/10.1038/s41524-025-01681-8 |
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