http://pubs.acs.org/doi/abs/10.1021/jz300328j

Modification of the Mg/DOBDC MOF with Amines to Enhance CO 2 Adsorption
from Ultradilute Gases

Sunho Choi, Taku Watanabe, Tae-Hyun Bae, David S. Sholl, Christopher W.
Jones

J. Phys. Chem. Lett., 2012, 3 (9), pp 1136–1141 DOI: 10.1021/jz300328j

The MOF Mg/DOBDC has one of the highest known CO 2 adsorption capacities at
the low to moderate CO 2 partial pressures relevant for CO 2 capture from
flue gas but is difficult to regenerate for use in cyclic operation. In
this work, Mg/DOBDC is modified by functionalization of its open metal
coordination sites with ethylene diamine (ED) to introduce pendent amines
into the MOF micropores. DFT calculations and experimental nitrogen
physisorption and thermogravimetric analysis suggest that 1 ED molecule is
added to each unit cell, on average. This modification both increases the
material’s CO 2 adsorption capacity at ultradilute CO 2 partial pressures
and increases the regenerability of the material, allowing for cyclic
adsorption–desorption cycles with identical adsorption capacities. This is
one of the first MOF materials demonstrated to yield significant adsorption
capacities from simulated ambient air (400 ppm CO 2 ), and its capacity is
competitive with the best-known adsorbents based on amine–oxide composites.

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