Experimental screening of porous materials for high pressure gas adsorption and evaluation in gas separations: Application to mofs (mil-100 and cau-10)

ACS Combinatorial Science

Volumn 15, Issue 2, 2013, Pages 111-119

  Wiersum, Andrew D ^a   Giovannangeli, Christophe ^a   Vincent, Dominique ^a   Bloch, Emily ^a   Reinsch, Helge ^b   Stock, Norbert ^b   Lee, Ji Sun ^c   Chang, Jong San ^c   Llewellyn, Philip L ^a  

^a AIX MARSEILLE UNIVERSITY   (France)

^b UNIVERSITY OF KIEL   (Germany)

^c Korea Research Institute of Chemical Technology   (South Korea)

Author keywords

CO2 capture; functionalization; gas adsorption; high throughput; metal organic framework; screening

Indexed keywords

CARBON MONOXIDE; NITROGEN; ORGANOMETALLIC COMPOUND;

ADSORPTION; ARTICLE; CHEMISTRY; ISOLATION AND PURIFICATION; POROSITY; PRESSURE; SURFACE PROPERTY;

ADSORPTION; CARBON MONOXIDE; NITROGEN; ORGANOMETALLIC COMPOUNDS; POROSITY; PRESSURE; SURFACE PROPERTIES;

EID: 84873692806     PISSN: 21568952     EISSN: None     Source Type: Journal    
DOI: 10.1021/co300128w     Document Type: Article

References (38)

1. Ruthven, D. M. Principles of Adsorption and Adsorption Processes; John Wiley and Sons: New York, 1984.
2. Yang, R. T. Adsorbent: Fundamentals and Applications; John Wiley & Sons Inc: New York, 2003.
3. Llewellyn, P. L.; Horcajada, P.; Maurin, G.; Devic, T.; Rosenbach, N.; Bourrelly, S.; Serre, C.; Vincent, D.; Loera-Serna, S.; Filinchuk, Y.; Ferey, G. Complex adsorption of short linear alkanes in the flexible metal-organic- framework MIL-53(Fe) J. Am. Chem. Soc. 2009, 131, 13002-13008
4. Garrido, J.; Linares-Solano, A.; Martin-Martinez, J. M.; Molina-Sabio, M.; Rodriguez-Reinoso, F.; Torregrosa, R. Use of nitrogen vs. carbon dioxide in the characterization of activated carbons Langmuir 1987, 3, 76-81
5. Stock, N. High-throughput investigations employing solvothermal syntheses Microporous Mesoporous Mater. 2010, 129 (3) 287-295
6. Stock, N.; Biswas, S. Synthesis of metal-organic frameworks (MOFs): Routes to various MOF Topologies, morphologies, and composites Chem. Rev. 2012, 112, 933-969
7. Micromeritics ASAP 2420 Accelerated Surface Area and Porosimetry System. http://www.micromeritics.com/Product-Showcase/ASAP-2420.aspx.
8. Quantachrome Autosorb-6B Surface Area and Pore Size Analyzer. http://www.quantachrome.com/gassorption/autosorb6.html.
9. Wollmann, P.; Leistner, M.; Stoeck, U.; Gruenker, R.; Gedrich, K.; Klein, N.; Throl, O.; Graehlert, W.; Senkovska, I.; Dreisbach, F.; Kaskel, S. High-throughput screening: speeding up porous materials discovery Chem. Commun. 2011, 47, 5151-5153
10. Wood, C. D.; Tan, B.; Trewin, A.; Niu, H.; Bradshaw, D.; Rosseinsky, M. J.; Khimyak, Y. Z.; Campbell, N. L.; Kirk, R.; Stoeckel, E.; Cooper, A. I. Hydrogen storage in microporous hypercrosslinked organic polymer networks Chem. Mater. 2007, 19 (8) 2034-2048
11. 2 Separation ACS Comb. Sci. 2012, 14, 263-267
12. Dueren, T.; Bae, Y.-S.; Snurr, R. Q. Using molecular simulation to characterise metal-organic frameworks for adsorption applications Chem. Soc. Rev. 2009, 38, 1237-1247
13. 2 mixtures in a Bio-MOF material from molecular simulations J. Phys. Chem. C 2011, 115, 6833-6840
14. Krishna, R.; van Baten, J. M. In silico screening of metal-organic frameworks in separation applications Phys. Chem. Chem. Phys. 2011, 13, 10593-10616
15. Kim, J.; Lin, L.-C.; Martin, R. L.; Swisher, J. A.; Haranczyk, M.; Smit, B. Large-scale computational screening of zeolites for ethane/ethene separation Langmuir 2012, 28, 11914-11919
16. Lin, L.-C.; Berger, A. H.; Martin, R. L.; Kim, J.; Swisher, J. A.; Jariwala, K.; Rycroft, C. H.; Bhown, A. S.; Deem, M. W.; Haranczyk, M.; Smit, B. In silico screening of carbon-capture materials Nat. Mater. 2012, 11, 633-641
17. Keskin, S.; Sholl, D. S. Efficient methods for screening of metal organic framework membranes for gas separations using atomically detailed models Langmuir 2009, 25, 11786-11795
18. Wiersum, A. D.; Chang, J.-S.; Serre, C.; Llewellyn, P. L. An adsorbent performance indicator as a first step evaluation of novel sorbents for gas separations: application to metal organic frameworks. Langmuir 2013, not supplied.
19. Ferey, G.; Serre, C.; Mellot-Draznieks, C.; Millange, F.; Surble, S.; Dutour, J.; Margiolaki, I. Molecular modeling: A hybrid solid with giant pores prepared by a combination of targeted chemistry, simulation, and powder diffraction Angew. Chem., Int. Ed. 2004, 43, 6296-6301
20. Reinsch, H.; van der Veen, M. A.; Gil, B.; Marszalek, B.; Verbiest, T.; De, V. D. E.; Stock, N. Structures, sorption characteristics and nonlinear optical properties of a new series of highly stable aluminium MOFs Chem. Mater. 2012, 10.1021/cm3025445
21. Horcajada, P.; Surble, S.; Serre, C.; Hong, D.-Y.; Seo, Y.-K.; Chang, J.-S.; Greneche, J.-M.; Margiolaki, I.; Ferey, G. Synthesis and catalytic properties of MIL-100(Fe), an iron(III) carboxylate with large pores Chem. Commun. 2007, 2820-2822
22. Seo, Y.-K.; Yoon, J. W.; Lee, J. S.; Lee, U. H.; Hwang, Y. K.; Jun, C.-H.; Horcajada, P.; Serre, C.; Chang, J.-S. Large scale fluorine-free synthesis of hierarchically porous iron(III) trimesate MIL-100(Fe) with a zeolite MTN topology Microporous Mesoporous Mater. 2012, 157, 137-145
23. Volkringer, C.; Popov, D.; Loiseau, T.; Ferey, G.; Burghammer, M.; Riekel, C.; Haouas, M.; Taulelle, F. Synthesis, single-crystal X-ray microdiffraction, and NMR characterizations of the giant pore metal-organic framework aluminum trimesate MIL-100 Chem. Mater. 2009, 21, 5695-5697
24. Lieb, A.; Leclerc, H.; Devic, T.; Serre, C.; Margiolaki, I.; Mahjoubi, F.; Lee, J. S.; Vimont, A.; Daturi, M.; Chang, J.-S. MIL-100(V)-A mesoporous vanadium metal organic framework with accessible metal sites Microporous Mesoporous Mater. 2012, 157, 18-23
25. Lemmon, E. W.; McLinden, H. M. MO Reference Fluid Thermodynamic and Transport Properties; REFPROP 8.0; National Institute of Standards and Technology: Gaithersburg, MD, 2007.
26. GUM 1995 with Minor Corrections; Joint Committee for Guides in Metrology: France, 2008.
27. Dueren, T.; Sarkisov, L.; Yaghi, O. M.; Snurr, R. Q. Design of new materials for methane storage Langmuir 2004, 20, 2683-2689
28. Frost, H.; Dueren, T.; Snurr, R. Q. Effects of surface area, free volume, and heat of adsorption on hydrogen uptake in metal-organic frameworks J. Phys. Chem. B 2006, 110, 9565-9570
29. 4 in mesoporous metal-organic frameworks MIL-100 and MIL-101 Langmuir 2008, 24, 7245-7250
30. Yoon, J. W.; Seo, Y.-K.; Hwang, Y. K.; Chang, J.-S.; Leclerc, H.; Wuttke, S.; Bazin, P.; Vimont, A.; Daturi, M.; Bloch, E.; Llewellyn, P. L.; Serre, C.; Horcajada, P.; Greneche, J.-M.; Rodrigues, A. E.; Ferey, G. Controlled reducibility of a metal-organic framework with coordinatively unsaturated sites for preferential gas sorption Angew. Chem., Int. Ed. 2010, 49, 5949-5952
31. Volkringer, C.; Leclerc, H.; Lavalley, J.-C.; Loiseau, T.; Ferey, G.; Daturi, M.; Vimont, A. Infrared spectroscopy investigation of the acid sites in the metal-organic framework aluminum trimesate MIL-100(Al) J. Phys. Chem. C 2012, 116, 5710-5719
32. Myers, A. L.; Prausnitz, J. M. Thermodynamics of mixed-gas adsorption AIChE J. 1965, 11, 121-7
33. Sircar, S.; Golden, T. C.; Rao, M. B. Activated-carbon for gas separation and storage Carbon 1996, 34, 1-12
34. Arstad, B.; Fjellvaag, H.; Kongshaug, K. O.; Swang, O.; Blom, R. Amine functionalised metal organic frameworks (MOFs) as adsorbents for carbon dioxide Adsorption 2008, 14, 755-762
35. 2 capture: The amino effect ChemSusChem 2011, 4, 1281-1290
36. Yang, Q.; Wiersum, A. D.; Llewellyn, P. L.; Guillerm, V.; Serre, C.; Maurin, G. Functionalizing porous zirconium terephthalate UiO-66(Zr) for natural gas upgrading based on a computational exploration Chem. Commun. 2011, 47, 9603-9605
37. 4 Chem. Commun. 2012, 48, 1135-1137
38. Rege, S. U.; Yang, R. T. A simple parameter for selecting an adsorbent for gas separation by pressure swing adsorption Sep. Sci. Technol. 2001, 36, 3355-3365