articleJournal of Colloid and Interface ScienceMay 4, 2025Closed access

Oxygen-transfer from N2O to CO via Y-doped Ti2CO2 (MXene) monolayer at room temperature: Density functional theory and ab initio molecular simulation studies

YYYang‐Xin Yu

Tsinghua University

PubMed
Indexed incrossrefpubmed

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42
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17.59
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100%
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42
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1

Topics & keywords

Topics
Keywords
  • Density functional theory
  • Monolayer
  • Ab initio
  • Oxygen
  • Doping
  • Chemistry
  • Computational chemistry
  • Materials science
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