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Investigation of Potential of Mn-Doped C60, Si60 and Al30P30 Nanocages to Oxidize the Formaldehyde to CO2

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Abstract

The formaldehyde (HCHO) is produced from building materials and it can cause illness and cancer in human. The oxidation of HCHO is acceptable pathway for HCHO purification to protect the human health. The catalytic activity of Manganese (Mn) doped carbon nanocage (Mn-C60), Mn doped silicon nanocage (Mn-Si60) and Mn doped aluminum phosphide nanocage (Mn-Al30P30) as effective catalysts for oxidation of HCHO to carbon dioxide (CO2) are investigated. The acceptable mechanisms for oxidation of HCHO to CO2 on surfaces of Mn-C60, Mn-Si60 and Mn-Al30P30 nanocages as catalysts are examined. Results shown HCHO is oxidized to CO2 on Mn-C60, Mn-Si60 and Mn-Al30P30 nanocage surfaces thought two acceptable mechanisms: (1) HCHO → HHCOO → HCOO → HCO → CO → CO2 and (2) HCHO → HHCOO → HCOO → CO2. The rate-limiting steps of pathways 1 and 2 are HCOO → HCO and HCHO → HHCOO. The metal doped nanocages (Mn-C60, Mn-Si60 and Mn-Al30P30) have excellent potential to development the patheways of HCHO oxidation with high performance. The results have proposed that the new strategy to increase enhance the catalytic ability of metal doped nanocages (Mn-C60, Mn-Si60 and Mn-Al30P30) for HCHO oxidation.

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Acknowledgements

Authors thank our University for computational support.

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Authors and Affiliations

  1. Hebei Province Zhonglian Energy Environmental Protection Technology Co., Ltd, Shijiazhuang, 050000, China

    Niu Wenbo

  2. Department of Pharmacy, Shijiazhuang Medical College, Shijiazhuang, 050599, China

    Chen Yang

Authors
  1. Niu Wenbo
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  2. Chen Yang
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Contributions

Niu Wenbo: Conceptualization, Methodology, Software, Formal analysis, Investigation Resources, Validation, Formal analysis, Investigation Resources, Chen Yang: Writing - Review & Editing, Visualization. Data Curation, Validation, Formal analysis, Investigation Resources, Validation, Validation, Formal analysis.

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Correspondence to Chen Yang.

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Wenbo, N., Yang, C. Investigation of Potential of Mn-Doped C60, Si60 and Al30P30 Nanocages to Oxidize the Formaldehyde to CO2. Silicon 16, 801–809 (2024). https://doi.org/10.1007/s12633-023-02718-7

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  • DOI: https://doi.org/10.1007/s12633-023-02718-7

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