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UID:3f0656cc-c9cb-49a8-a128-7b3c8a7b0224@avs.org
DTSTAMP:20260429T184205Z
DTSTART:20221116T180000Z
DTEND:20221116T190000Z
LOCATION: Virtual/Online
DESCRIPTION:\nThe ability to design, tune and successfully test nanoporous crystalline materials allows for the development and commercialization of materials for many different environmental and energy applications. Metal-organic frameworks (MOFs) have shown great potential in challenging separations of molecules with very similar kinetic diameters. One area of strong focus in our lab is toward a fundamental understanding of the structure-property relationship of selective adsorption in MOFs. Here our team has implemented a synergistic approach involving predictive molecular modeling, experimental synthesis, and advanced testing to enable rapid discovery of new materials. Density functional theory (DFT) calculations were used to measure the binding energy for various gases on coordinatively unsaturated metal sites in MOFs. The modeling guides the materials synthesis, which in turn is supported by laboratory testing. Results then are used to validate and optimize the models for continuous advancements. Applications as adsorbents and direct electrical readout sensors will be presented.\n\n Virtual/Online\n\n Heather Korff
SUMMARY: AVS e-Talk: Design, Realization, Applications of Gas and Ion Separations Materials
PRIORITY:3
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DESCRIPTION:Reminder
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