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- W4387304564 abstract "Abstract Metal-organic frameworks (MOFs) have become materials platform with vast structural diversity, tailorable for broad practical applications. Traditional bottom-up and top-down design approaches played a pivotal role for a rapid increase in MOF structures, yet the systematic screening for unknown synthesizable MOFs is still a daunting challenge. Herein, we developed a novel search paradigm, the Up-Down Approach (UDA), by merging the bottom-up and top-down approaches. Targeting the famous class of Zr-based MOFs, we searched promising topology candidates and unveiled 17 future structural configurations by considering the possible orientations of Zr 6 clusters. Through ribbon representation and sophisticated analysis of the ligand angles, we suggested future structure models and successfully synthesized one of the suggested structures with a novel scu configuration. The UDA will accelerate the discovery of hidden MOFs, providing exciting new opportunities to effectively expand the chemical space of MOFs." @default.
- W4387304564 created "2023-10-04" @default.
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- W4387304564 date "2023-10-03" @default.
- W4387304564 modified "2023-10-14" @default.
- W4387304564 title "Expanding chemical space of metal-organic frameworks via up-down approach" @default.
- W4387304564 doi "https://doi.org/10.21203/rs.3.rs-3358932/v1" @default.
- W4387304564 hasPublicationYear "2023" @default.
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