Strong Metal–Support Interactions between Copper and Iron Oxide during the High‐Temperature Water‐Gas Shift Reaction
The commercial high‐temperature water‐gas shift (HT‐WGS) catalyst consists of CuO‐Cr2O3‐Fe2O3, where Cu functions as a chemical promoter to increase the catalytic activity, but its promotion mechanism is poorly understood. In this work, a series of iron‐based model catalysts were investigated with i...
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| Published in | Angewandte Chemie (International ed.) Vol. 58; no. 27; pp. 9083 - 9087 |
|---|---|
| Main Authors | , , , , , , , |
| Format | Journal Article |
| Language | English |
| Published |
Germany
Wiley Subscription Services, Inc
01.07.2019
Wiley Blackwell (John Wiley & Sons) |
| Edition | International ed. in English |
| Subjects | |
| Online Access | Get full text |
| ISSN | 1433-7851 1521-3773 1521-3773 |
| DOI | 10.1002/anie.201903298 |
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| Abstract | The commercial high‐temperature water‐gas shift (HT‐WGS) catalyst consists of CuO‐Cr2O3‐Fe2O3, where Cu functions as a chemical promoter to increase the catalytic activity, but its promotion mechanism is poorly understood. In this work, a series of iron‐based model catalysts were investigated with in situ or pseudo in situ characterization, steady‐state WGS reaction, and density function theory (DFT) calculations. For the first time, a strong metal‐support interaction (SMSI) between Cu and FeOx was directly observed. During the WGS reaction, a thin FeOx overlayer migrates onto the metallic Cu particles, creating a hybrid surface structure with Cu‐FeOx interfaces. The synergistic interaction between Cu and FeOx not only stabilizes the Cu clusters, but also provides new catalytic active sites that facilitate CO adsorption, H2O dissociation, and WGS reaction. These new fundamental insights can potentially guide the rational design of improved iron‐based HT‐WGS catalysts.
Strong metal–support interactions between metallic copper and iron oxides were observed during the high‐temperature water‐gas shift (WGS) reaction. Such a synergistic interaction not only stabilizes the Cu clusters, but also provides new catalytic active sites that facilitate CO adsorption, H2O dissociation, and WGS reaction. |
|---|---|
| AbstractList | Abstract
The commercial high‐temperature water‐gas shift (HT‐WGS) catalyst consists of CuO‐Cr
2
O
3
‐Fe
2
O
3
, where Cu functions as a chemical promoter to increase the catalytic activity, but its promotion mechanism is poorly understood. In this work, a series of iron‐based model catalysts were investigated with in situ or pseudo in situ characterization, steady‐state WGS reaction, and density function theory (DFT) calculations. For the first time, a strong metal‐support interaction (SMSI) between Cu and FeO
x
was directly observed. During the WGS reaction, a thin FeO
x
overlayer migrates onto the metallic Cu particles, creating a hybrid surface structure with Cu‐FeO
x
interfaces. The synergistic interaction between Cu and FeO
x
not only stabilizes the Cu clusters, but also provides new catalytic active sites that facilitate CO adsorption, H
2
O dissociation, and WGS reaction. These new fundamental insights can potentially guide the rational design of improved iron‐based HT‐WGS catalysts. The commercial high-temperature water-gas shift (HT-WGS) catalyst consists of CuO-Cr2 O3 -Fe2 O3 , where Cu functions as a chemical promoter to increase the catalytic activity, but its promotion mechanism is poorly understood. In this work, a series of iron-based model catalysts were investigated with in situ or pseudo in situ characterization, steady-state WGS reaction, and density function theory (DFT) calculations. For the first time, a strong metal-support interaction (SMSI) between Cu and FeOx was directly observed. During the WGS reaction, a thin FeOx overlayer migrates onto the metallic Cu particles, creating a hybrid surface structure with Cu-FeOx interfaces. The synergistic interaction between Cu and FeOx not only stabilizes the Cu clusters, but also provides new catalytic active sites that facilitate CO adsorption, H2 O dissociation, and WGS reaction. These new fundamental insights can potentially guide the rational design of improved iron-based HT-WGS catalysts.The commercial high-temperature water-gas shift (HT-WGS) catalyst consists of CuO-Cr2 O3 -Fe2 O3 , where Cu functions as a chemical promoter to increase the catalytic activity, but its promotion mechanism is poorly understood. In this work, a series of iron-based model catalysts were investigated with in situ or pseudo in situ characterization, steady-state WGS reaction, and density function theory (DFT) calculations. For the first time, a strong metal-support interaction (SMSI) between Cu and FeOx was directly observed. During the WGS reaction, a thin FeOx overlayer migrates onto the metallic Cu particles, creating a hybrid surface structure with Cu-FeOx interfaces. The synergistic interaction between Cu and FeOx not only stabilizes the Cu clusters, but also provides new catalytic active sites that facilitate CO adsorption, H2 O dissociation, and WGS reaction. These new fundamental insights can potentially guide the rational design of improved iron-based HT-WGS catalysts. The commercial high‐temperature water‐gas shift (HT‐WGS) catalyst consists of CuO‐Cr 2 O 3 ‐Fe 2 O 3 , where Cu functions as a chemical promoter to increase the catalytic activity, but its promotion mechanism is poorly understood. In this work, a series of iron‐based model catalysts were investigated with in situ or pseudo in situ characterization, steady‐state WGS reaction, and density function theory (DFT) calculations. For the first time, a strong metal‐support interaction (SMSI) between Cu and FeO x was directly observed. During the WGS reaction, a thin FeO x overlayer migrates onto the metallic Cu particles, creating a hybrid surface structure with Cu‐FeO x interfaces. The synergistic interaction between Cu and FeO x not only stabilizes the Cu clusters, but also provides new catalytic active sites that facilitate CO adsorption, H 2 O dissociation, and WGS reaction. These new fundamental insights can potentially guide the rational design of improved iron‐based HT‐WGS catalysts. The commercial high‐temperature water‐gas shift (HT‐WGS) catalyst consists of CuO‐Cr2O3‐Fe2O3, where Cu functions as a chemical promoter to increase the catalytic activity, but its promotion mechanism is poorly understood. In this work, a series of iron‐based model catalysts were investigated with in situ or pseudo in situ characterization, steady‐state WGS reaction, and density function theory (DFT) calculations. For the first time, a strong metal‐support interaction (SMSI) between Cu and FeOx was directly observed. During the WGS reaction, a thin FeOx overlayer migrates onto the metallic Cu particles, creating a hybrid surface structure with Cu‐FeOx interfaces. The synergistic interaction between Cu and FeOx not only stabilizes the Cu clusters, but also provides new catalytic active sites that facilitate CO adsorption, H2O dissociation, and WGS reaction. These new fundamental insights can potentially guide the rational design of improved iron‐based HT‐WGS catalysts. Strong metal–support interactions between metallic copper and iron oxides were observed during the high‐temperature water‐gas shift (WGS) reaction. Such a synergistic interaction not only stabilizes the Cu clusters, but also provides new catalytic active sites that facilitate CO adsorption, H2O dissociation, and WGS reaction. The commercial high-temperature water-gas shift (HT-WGS) catalyst consists of CuO-Cr O -Fe O , where Cu functions as a chemical promoter to increase the catalytic activity, but its promotion mechanism is poorly understood. In this work, a series of iron-based model catalysts were investigated with in situ or pseudo in situ characterization, steady-state WGS reaction, and density function theory (DFT) calculations. For the first time, a strong metal-support interaction (SMSI) between Cu and FeO was directly observed. During the WGS reaction, a thin FeO overlayer migrates onto the metallic Cu particles, creating a hybrid surface structure with Cu-FeO interfaces. The synergistic interaction between Cu and FeO not only stabilizes the Cu clusters, but also provides new catalytic active sites that facilitate CO adsorption, H O dissociation, and WGS reaction. These new fundamental insights can potentially guide the rational design of improved iron-based HT-WGS catalysts. The commercial high‐temperature water‐gas shift (HT‐WGS) catalyst consists of CuO‐Cr2O3‐Fe2O3, where Cu functions as a chemical promoter to increase the catalytic activity, but its promotion mechanism is poorly understood. In this work, a series of iron‐based model catalysts were investigated with in situ or pseudo in situ characterization, steady‐state WGS reaction, and density function theory (DFT) calculations. For the first time, a strong metal‐support interaction (SMSI) between Cu and FeOx was directly observed. During the WGS reaction, a thin FeOx overlayer migrates onto the metallic Cu particles, creating a hybrid surface structure with Cu‐FeOx interfaces. The synergistic interaction between Cu and FeOx not only stabilizes the Cu clusters, but also provides new catalytic active sites that facilitate CO adsorption, H2O dissociation, and WGS reaction. These new fundamental insights can potentially guide the rational design of improved iron‐based HT‐WGS catalysts. |
| Author | Tian, Pengfei Xu, Jing Wachs, Israel E. Han, Yi‐Fan Lunkenbein, Thomas Schlögl, Robert Zhu, Minghui Kurtz, Ravi |
| Author_xml | – sequence: 1 givenname: Minghui orcidid: 0000-0003-1593-9320 surname: Zhu fullname: Zhu, Minghui organization: East China University of Science and Technology – sequence: 2 givenname: Pengfei orcidid: 0000-0003-0261-8536 surname: Tian fullname: Tian, Pengfei organization: East China University of Science and Technology – sequence: 3 givenname: Ravi surname: Kurtz fullname: Kurtz, Ravi organization: Lehigh University – sequence: 4 givenname: Thomas surname: Lunkenbein fullname: Lunkenbein, Thomas organization: Fritz-Haber-Institut der Max-Planck-Gesellschaft – sequence: 5 givenname: Jing surname: Xu fullname: Xu, Jing organization: East China University of Science and Technology – sequence: 6 givenname: Robert surname: Schlögl fullname: Schlögl, Robert organization: Fritz-Haber-Institut der Max-Planck-Gesellschaft – sequence: 7 givenname: Israel E. surname: Wachs fullname: Wachs, Israel E. organization: Lehigh University – sequence: 8 givenname: Yi‐Fan orcidid: 0000-0001-7360-2342 surname: Han fullname: Han, Yi‐Fan email: yifanhan@ecust.edu.cn organization: Zhengzhou University |
| BackLink | https://www.ncbi.nlm.nih.gov/pubmed/31074080$$D View this record in MEDLINE/PubMed https://www.osti.gov/biblio/1518524$$D View this record in Osti.gov |
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| Keywords | iron oxide water-gas shift reaction copper hydrogen metal-support interactions |
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| Snippet | The commercial high‐temperature water‐gas shift (HT‐WGS) catalyst consists of CuO‐Cr2O3‐Fe2O3, where Cu functions as a chemical promoter to increase the... The commercial high‐temperature water‐gas shift (HT‐WGS) catalyst consists of CuO‐Cr 2 O 3 ‐Fe 2 O 3 , where Cu functions as a chemical promoter to increase... The commercial high-temperature water-gas shift (HT-WGS) catalyst consists of CuO-Cr O -Fe O , where Cu functions as a chemical promoter to increase the... The commercial high-temperature water-gas shift (HT-WGS) catalyst consists of CuO-Cr2 O3 -Fe2 O3 , where Cu functions as a chemical promoter to increase the... Abstract The commercial high‐temperature water‐gas shift (HT‐WGS) catalyst consists of CuO‐Cr 2 O 3 ‐Fe 2 O 3 , where Cu functions as a chemical promoter to... |
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| SubjectTerms | Catalysis Catalysts Catalytic activity Copper Copper oxides Density functional theory hydrogen Interfaces iron oxide Iron oxides metal–support interactions Organic chemistry Shift reaction Surface structure water-gas shift reaction |
| Title | Strong Metal–Support Interactions between Copper and Iron Oxide during the High‐Temperature Water‐Gas Shift Reaction |
| URI | https://onlinelibrary.wiley.com/doi/abs/10.1002%2Fanie.201903298 https://www.ncbi.nlm.nih.gov/pubmed/31074080 https://www.proquest.com/docview/2253678080 https://www.proquest.com/docview/2231947424 https://www.osti.gov/biblio/1518524 |
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