Finely tuned inverse design of metal–organic frameworks with user-desired Xe/Kr selectivity
Yunsung Lim, Junkil Park, Sangwon Lee, Jihan Kim
Abstract
The platform developed in this work can generate user-desired materials which can lead to design of high performance materials for xenon/krypton separation.
Topics & Concepts
KryptonXenonSelectivityInverseMaterials scienceComputer scienceWork (physics)ChemistryEngineeringPhysicsMechanical engineeringAtomic physicsMathematicsOrganic chemistryGeometryCatalysisMetal-Organic Frameworks: Synthesis and ApplicationsMachine Learning in Materials ScienceCovalent Organic Framework Applications