Ir catalysts: Preventing CH3COOH formation in ethanol oxidation (Record no. 53875)

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fixed length control field 01324nam a2200229Ia 4500
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control field MX-MdCICY
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control field 20250625162436.0
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Transcribing agency CICY
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Classification number (OCLC) (R) ; Classification number, CALL (RLIN) (NR) B-19756
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Title Ir catalysts: Preventing CH3COOH formation in ethanol oxidation
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Volume/sequential designation Chemical Physics Letters, 688, p.92-97, 2017
520 3# - SUMMARY, ETC.
Summary, etc. Current catalysts used for ethanol oxidation reaction (EOR)cannot effectively prevent CH3COOH formation, and thus become a major hindrance for direct ethanol fuel cell applications. We report an Ir catalyst that shows great promise for a complete EOR based on density functional theory calculations using PBE functional. The reaction barrier on Ir(1 0 0)was found to be 2.10 eV for CH3COOH formation, which is much higher than currently used Pd and Pt, and 0.57 eV for C C bond cleavage in CHCO species, which are comparable to Pd and Pt. The result suggests future directions for studying optimal complete EOR catalysts.
700 12 - ADDED ENTRY--PERSONAL NAME
Personal name Miao, B.
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Personal name Wu, Z.
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Personal name Xu, H.
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Personal name Zhang, M.
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Personal name Chen, Y.
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Personal name Wang, L.
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Uniform Resource Identifier <a href="https://drive.google.com/file/d/1hG8mmz6UkBBIRNDtXnzGmWaUwwJ252t_/view?usp=drivesdk">https://drive.google.com/file/d/1hG8mmz6UkBBIRNDtXnzGmWaUwwJ252t_/view?usp=drivesdk</a>
Public note Para ver el documento ingresa a Google con tu cuenta: @cicy.edu.mx
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Source of classification or shelving scheme Clasificación local
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  Clasificación local     Ref1 CICY CICY Documento préstamo interbibliotecario 25.06.2025   B-19756 25.06.2025 25.06.2025 Documentos solicitados