Molecular screening of ionic liquids for CO2 absorption and molecular dynamic simulation
Though ionic liquids (ILs) are considered potential materials for CO2 capture because of their unique properties, it is time-consuming and costly to choose task-specific and suitable IL using the traditional “try-and-error” method. From the point of molecular design view, 25 cations and 20 anions ar...
| Main Authors: | , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
De Gruyter
2022-04-01
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| Series: | Open Chemistry |
| Subjects: | |
| Online Access: | https://doi.org/10.1515/chem-2022-0154 |