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Xi-Lin Jia

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Open access Oct 2026

Beyond a Plausible Model: Lessons from Revisiting the Structure of a Covalent Organic Framework

Precise structural determination is essential for understanding and controlling the properties of covalent organic frameworks (COFs), yet most COF structures are not solved from single-crystal diffraction data but inferred from chemically plausible models constrained primarily by powder X-ray diffraction. Although in...

Qiao Zhang, Meng-Ting Hu, Xi-Lin Jia et al. · 0 citations
Oct 2026

Sequential Oxygen Vacancy Formation Governs Cu Size-Dependent Methanol Synthesis at Cu–ZrO2 Interfaces

Methanol synthesis at Cu–ZrO2 interfaces requires CO2 activation, H2 dissociation, and conversion of oxygenated intermediates to proceed in concert, yet how Cu aggregation coordinates these functions remains unclear. Electronic-structure calculations, molecular dynamics, and catalytic experiments show that Cu size go...

Zi-Ran Lv, Chen-Yu Ding, Wen-Jing Sun et al. · 0 citations

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