Journal
CHEMISTRY-A EUROPEAN JOURNAL
Volume 22, Issue 52, Pages 18705-18708Publisher
WILEY-V C H VERLAG GMBH
DOI: 10.1002/chem.201604009
Keywords
adsorption; carbon dioxide; diffusion; molecular dynamics; Monte Carlo simulation
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Funding
- European Research Council under the European Union's Seventh Framework Programme(FP7)/ERC [279520]
- European Research Council (ERC) [279520] Funding Source: European Research Council (ERC)
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The separation of carbon dioxide from flue gas is essential for the reduction of greenhouse gas emissions. In adsorptive methods, the challenge lies in the choice of suitable porous materials. Among all zeolite topologies, a number of adsorbents with pore dimensions in the range of the guest molecules were identified to allow an excellent separation by diffusion, and MRE and AFO zeolite topologies appear to be the best candidates based on equilibrium adsorption. Also, it was found that the behavior of this gas mixture in DFT and APD zeolites differed from the normal behavior.
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