122nd General Meeting of the KCS

Type Symposium
Area Recent Research Activities in Solid-State Materials
Room No. Room 323
Time FRI 10:30-:
Code INOR2-5
Subject Data-Driven Discovery of New Porous Materials
Authors Wonyoung Choe
Department of Chemistry, Ulsan National Institute of Science and Technology, Korea
Abstract From state-of-art meta materitals and catalysts for petrochemical industries, porous materials play important roles in science and industries. A rising subclass of porous materials includes zeolitic imidazolate frameworks (ZIFs). Despite strong structural similarities between these ZIFs and zeolites, only limited numbers of ZIFs are synthetically accessible. In this presentation, we show how hypothetical zeolite databases can be helpful to identify possible ZIF structures, utilizing simple chemical descriptors, and discuss the impact of such data-driven approach for accessing new porous materials.
E-mail chem571@gmail.com