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XRD-DSC: a screening tool for identifying effective MOFs for selective gas sorption from humid gas streams

Published online by Cambridge University Press:  07 February 2019

John B Parise Open the ORCID record for John B Parise [Opens in a new window] ,
Xianyin Chen ,
Anna M. Plonka ,
William R. Woerner ,
Debasis Banerjee ,
David Connors  and
Nancy Goroff
John B Parise*
Affiliation:
Joint Photon Sciences Institute, Stony Brook University, New York 11794-2100 Department of Geosciences, Stony Brook University, New York 11794-2100 Department of Chemistry, Stony Brook University, New York 11794-3400
Xianyin Chen
Affiliation:
Department of Chemistry, Stony Brook University, New York 11794-3400
Anna M. Plonka
Affiliation:
Department of Materials Science and Chemical Engineering, Stony Brook University, New York 11794-2275
William R. Woerner
Affiliation:
EAG Laboratories, Sunnyvale, California 94086
Debasis Banerjee
Affiliation:
Department of Chemistry, Stony Brook University, New York 11794-3400
David Connors
Affiliation:
Department of Chemistry, Stony Brook University, New York 11794-3400
Nancy Goroff
Affiliation:
Department of Chemistry, Stony Brook University, New York 11794-3400
*
a)Author to whom correspondence should be addressed. Electronic mail: [email protected]
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Abstract

A commercially available combined X-ray diffraction – differential scanning calorimetry (XRD-DSC) stage was adapted for studies of gas loading in microporous materials, including metal organic frameworks (MOFs). Insertion of a custom-built humid atmosphere swing chamber (HASC) between a humidity generator and the XRD-DSC stage facilitates both humid atmosphere and vacuum swing gas loading. The HASC is necessary to buffer between the humidity generator and the XRD-DSC stage, allowing the gas mixture to homogenize prior to sample exposure, so that both humid atmosphere and vacuum swings could be performed. The changes in XRD can be used to follow structural changes, including collapse, which is indicative of a lack of microporosity upon activation, and the flexibity of frameworks upon gas sorption–desorption cycles. Measurements of the area under the DSC curve allows for calculation of the isosteric heat of adsorption (Qst; kJ molGAS−1). Vacuum-atmosphere swing experiments performed at different pressure steps allow for the reconstruction of the enthalpy of gas adsorption before and after a phase transition. These modes of operation are illustrated in three case studies from a program of exploratory MOF synthesis used to discover novel materials for selective gas sorption from humid gas streams: (1) gas binding in Stony Brook metal organic framework-1, (2) zeolitic imidazolate framework-7 response to variable pressure vacuum-atmosphere swing, and (3) high throughput evaluation of the selectivity of novel MOFs synthesized from customized linkers.

Keywords

differential scanning calorimetrypowder X-ray diffractionXRDDSCmetal organic frameworksMOFmicroporous materialsseparationscombined in situ techniquesgas loadingadsorptioncarbon dioxide capturerelative humidityhigh throughput
Type
Review Article
Information
Powder Diffraction , Volume 34 , Issue 1 , March 2019 , pp. 3 - 12
Copyright
Copyright © International Centre for Diffraction Data 2019 

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