Metal organic frameworks (MOB) have shown adsorption behavior that is not observed in other microporous materials such as zeolites or activated carbons This study used grand canonical Monte Carlo simulation to evaluate a particular form of behavior, which corresponds to the presence of unusual type V adsorption isotherms Study ()fa series of MOFs in the IRMOF family. containing chemically similar linkers of different length, showed that the presence of type V adsorption depends on a fine balance between the strength of the fluid-fluid and fluid-solid Interactions, which in turn is a strong function of the length of the linker and therefore the pore size A transition from type V behavior to the more common type I behavior is observed as the temperature increases The temperature at which this transition occurs increases, and the transition becomes more diffuse, as the length of the linker increases This type V behavior leads to an interesting possibility in the design of MOF adsorbents for use in gas separation and gas slot age applications
机构:
London South Bank Univ, Sch Engn, London SE1 0AA, England
Imperial Coll London, Dept Mat, London SW7 2AZ, England
Univ Sussex, Dept Chem, Brighton BN1 9QJ, E Sussex, EnglandLondon South Bank Univ, Sch Engn, London SE1 0AA, England
Dunne, Lawrence J.
Manos, George
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UCL, Dept Chem Engn, Torrington Pl, London WC1E 7JE, EnglandLondon South Bank Univ, Sch Engn, London SE1 0AA, England
Manos, George
PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES,
2018,
376
(2115):
机构:
Univ Southern Calif, Mork Family Dept Chem Engn & Mat Sci, Los Angeles, CA 90089 USAUniv Southern Calif, Mork Family Dept Chem Engn & Mat Sci, Los Angeles, CA 90089 USA
Bakhshian, Sahar
Sahimi, Muhammad
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Univ Southern Calif, Mork Family Dept Chem Engn & Mat Sci, Los Angeles, CA 90089 USAUniv Southern Calif, Mork Family Dept Chem Engn & Mat Sci, Los Angeles, CA 90089 USA
机构:
Stanford Univ, Dept Chem, Stanford, CA 94305 USAStanford Univ, Dept Mat Sci & Engn, Stanford, CA 94305 USA
Liu, Nian
Yao, Yan
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Stanford Univ, Dept Mat Sci & Engn, Stanford, CA 94305 USAStanford Univ, Dept Mat Sci & Engn, Stanford, CA 94305 USA
Yao, Yan
Cha, Judy J.
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Stanford Univ, Dept Mat Sci & Engn, Stanford, CA 94305 USAStanford Univ, Dept Mat Sci & Engn, Stanford, CA 94305 USA
Cha, Judy J.
McDowell, Matthew T.
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Stanford Univ, Dept Mat Sci & Engn, Stanford, CA 94305 USAStanford Univ, Dept Mat Sci & Engn, Stanford, CA 94305 USA
McDowell, Matthew T.
Han, Yu
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King Abdullah Univ Sci & Technol, Adv Membrane & Porous Mat Ctr, Thuwal 239556900, Saudi ArabiaStanford Univ, Dept Mat Sci & Engn, Stanford, CA 94305 USA
Han, Yu
Cui, Yi
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Stanford Univ, Dept Mat Sci & Engn, Stanford, CA 94305 USA
SLAC Natl Accelerator Lab, Stanford Inst Mat & Energy Sci, Menlo Pk, CA 94025 USAStanford Univ, Dept Mat Sci & Engn, Stanford, CA 94305 USA