journal article·2026

Dynamic Linker Distortion in Zr-MOF-808 Driven by Adsorbates: A Machine Learning and Enhanced Sampling Study

Yinan Xu, Mukunda Mandal, Jireh García Sánchez, Yezhi Jin, Gustavo Roberto Pérez Lemus, Massimiliano Delferro, Laura Gagliardi, Juan J. de Pablo

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Abstract

Metal-organic frameworks (MOFs) are often viewed as rigid structures. However, growing experimental evidence indicates that their metal-linker connections can be quite flexible, and this flexibility could play an important role...
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Source: crossref · Quality: short

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