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The sorption and separation mechanism of CO2 in covalent organic frameworks with different aligned structures: DFT and molecular dynamic simulations

Yuhua Wang, Weihua Wang, Zhiqiang Zhang, Ping Li

2021Applied Surface Science31 citationsDOI

Topics & Concepts

SorptionStackingCovalent bondAdsorptionChemical engineeringChemistryGas separationMaterials scienceNanotechnologyOrganic chemistryEngineeringMembraneBiochemistryCovalent Organic Framework ApplicationsMetal-Organic Frameworks: Synthesis and ApplicationsCarbon Dioxide Capture Technologies
The sorption and separation mechanism of CO2 in covalent organic frameworks with different aligned structures: DFT and molecular dynamic simulations | Litcius