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University of South Florida

Air purification

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Understanding Gas Sorption Mechanisms In Metal–Organic Materials Via Computational Experimentation, Katherine A. Forrest Nov 2017

Understanding Gas Sorption Mechanisms In Metal–Organic Materials Via Computational Experimentation, Katherine A. Forrest

USF Tampa Graduate Theses and Dissertations

Metal–organic materials (MOMs), a type of porous crystalline structure composed of organic ligands jointed with metal ions, have captured the interest of scientists as potentially useful in gas sorption applications. Some of the most crucial avenues of investigation are in H2 storage (for use as a clean burning fuel source) and CO2 capture and sequestration (to remove the greenhouse gas from the environment).

A major advantage of MOMs for such applications is their high variability in terms of physical dimensions and chemical moieties, based on composition and synthesis conditions, making them potentially customizable for specific application if necessary structural characteristics …