Catalysis Communications (Jan 2021)

Understanding composition-dependent catalytic performance of PdAg for the hydrogenation of 1,3-butadiene to 1-butene

  • Haowen Ma,
  • Xiaopei Xu,
  • Haoxiang Xu,
  • Huixia Feng,
  • Yuan Xie,
  • Daojian Cheng

DOI
https://doi.org/10.1016/j.catcom.2020.106255
Journal volume & issue
Vol. 149
p. 106255

Abstract

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The composition-dependent adsorption and catalytic properties of PdAg bimetallic surfaces for the partial hydrogenation of 1,3-butadiene to 1-butene were studied by density functional theory. With the increase of Ag content, the activity and selectivity for the partial hydrogenation of 1,3-butadiene to 1-butene were enhanced with the decrease in binding strength of adsorbates. The increase of surface Ag content in PdAg catalysts can thus enhance the catalytic performance of the hydrogenation of 1,3-butadiene.

Keywords