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February 14, 2026AIChE Journal0 citations

Modulation of MnO bond by phosphate for boosting ozone decomposition efficiency

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WLWenyan LiuXDXue DengBWBinxia Wang

Key Points

  • The aim is to improve the efficiency of ozone decomposition through the modulation of MnO bonds in catalysts.
  • Developed a phosphate-modified layered double hydroxides catalyst (PO4-LDH)
  • Analyzed ozone decomposition rates and catalyst performance using specific reaction metrics
  • Utilized density functional theory (DFT) calculations to evaluate energy barriers associated with the reaction
  • Conducted in situ Raman spectroscopy and diffuse reflectance infrared Fourier transform spectra (DRIFTS) for surface analysis
  • Achieved an ozone decomposition reaction rate of 254.29 μmol g−1 min−1, surpassing existing catalysts
  • Demonstrated that PO4-LDH had an elongated MnO bond and reduced coordination number
  • Reduced energy barriers for key reaction steps were predicted by DFT calculations
  • Increased generation of atomic oxygen and reduced intermediate peroxides were confirmed by spectral analyses

Abstract

Abstract Catalytic decomposition of ground‐level ozone is proven to be the most efficient and eco‐friendly method for the ozone treatment. Regulating the structure of Mn‐based catalysts has been the primary research focus. But there remains a lack of effective methods to precisely regulate MnO bonds for ground‐breaking catalytic performance. In this study, a PO 4 3− modified layered double hydroxides catalyst (PO 4 ‐LDH) is reported, which is featured with an elongated MnO bond and reduced MnO coordination number. The ozone decomposition reaction rate reached 254.29 μmol g −1 min −1 , which is preponderant to the state‐of‐the‐art LDH catalysts. Density functional theory (DFT) calculation indicated that the energy barrier of endothermic sub‐steps can all be reduced, including the catalytic step and desorption step. In situ Raman spectra and diffuse reflectance infrared Fourier transform spectra (DRIFTS) further proved that more atomic oxygen can be generated on the surface of PO 4 ‐LDH, and intermediate peroxides were reduced due to the accelerated desorption.

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Cite This Study

Liu et al. (2026) studied this question.

synapsesocial.com/papers/699011812ccff479cfe58432https://doi.org/10.1002/aic.70292
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