Article,
Deciphering the controlling factors for phase transitions in zeolitic imidazolate frameworks
Affiliations
- [1] Aalborg Univ, Dept Chem & Biosci, DK-9220 Aalborg, Denmark [NORA names: AAU Aalborg University; University; Denmark; Europe, EU; Nordic; OECD];
- [2] Michigan Technol Univ, Dept Mech Engn Engn Mech, Houghton, MI 49931 USA [NORA names: United States; America, North; OECD];
- [3] Univ Calif Los Angeles, Dept Civil & Environm Engn, Phys AmoRphous & Inorgan Solids Lab PARISlab, Los Angeles, CA 90095 USA [NORA names: United States; America, North; OECD];
- [4] Univ Calif Los Angeles, Dept Civil & Environm Engn, Phys AmoRphous & Inorgan Solids Lab PARISlab, Los Angeles, CA 90095 USA [NORA names: United States; America, North; OECD]
Abstract
A new structural descriptor, the ring orientation index, is proposed as a governing factor for phase transitions in zeolitic imidazolate frameworks (ZIFs), facilitating the design of ZIF glasses for various applications.
Keywords
glass formation,
melting,
metal-organic frameworks,
phase transitions,
ring orientation,
transferable deep learning force field