Abstract
Gas sorption experiments and grand canonical Monte Carlo simulations for two isostructural microporous metal azolate frameworks show that even partially exposed uncoordinated nitrogens can effectively increase gas binding affinity and overcome the pore size confinement effect.
Keywords
Microporous materialIsostructuralChemistrySorptionPorosityPolymerMonte Carlo methodCoordination polymerPorous mediumMetal-organic frameworkGrand canonical ensembleChemical engineeringPolymer chemistryPhysical chemistryOrganic chemistryCrystal structureAdsorption
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Publication Info
- Year
- 2010
- Type
- article
- Volume
- 132
- Issue
- 19
- Pages
- 6654-6656
- Citations
- 307
- Access
- Closed
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Cite This
Jian‐Bin Lin,
Jie‐Peng Zhang,
Xiao‐Ming Chen
(2010).
Nonclassical Active Site for Enhanced Gas Sorption in Porous Coordination Polymer.
Journal of the American Chemical Society
, 132
(19)
, 6654-6656.
https://doi.org/10.1021/ja1009635
Identifiers
- DOI
- 10.1021/ja1009635