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Linker Functionalization and pH Tuning Enhance Solar-Driven Catalytic CO$_2$ Reduction in MOF-5
The wide band gap of metal-organic framework (MOF) 5 constrains its use in photocatalytic carbon dioxide (CO$_2$) reduction despite its high porosity and favorable mass-transport properties. Adopting a state-of-the-art first-principles approach, we systematically investigate the effects of volumetri
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