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Title:Selective glucose oxidation to glucaric acid using bimetallic catalysts : lattice expansion or electronic structure effect?
Authors:ID Lavrič, Žan (Author)
ID Teržan, Janvit (Author)
ID Kroflič, Ana (Author)
ID Zavašnik, Janez (Author)
ID Olszówka, Joanna E. (Author)
ID Vajda, Štefan (Author)
ID Huš, Matej (Author)
ID Grilc, Miha (Author)
ID Likozar, Blaž (Author)
Files:URL URL - Source URL, visit https://www.sciencedirect.com/science/article/pii/S0926337323010986?via%3Dihub
 
.pdf PDF - Presentation file, download (2,73 MB)
MD5: 0ABF682A7B8734861463DC0058D263F5
 
Language:English
Typology:1.01 - Original Scientific Article
Organization:Logo KI - National Institute of Chemistry
Abstract:Our study presents a comprehensive approach for the selective oxidation of glucose to glucaric acid (GA) by heterogeneous catalysis. We have synthesized and characterized Au/ZrO2, AuCu/ZrO2 and AuPt/ZrO2 catalysts using X-ray diffraction (XRD), transmission electron microscopy (TEM), X-ray photoelectron spectroscopy (XPS), and oxygen pulse chemisorption (OPS) techniques. Combining experimental observations with in-depth density functional theory (DFT) studies, we found that bimetallic catalysts form alloys, which exhibit different characteristics than monometallic counterparts for the given reaction. We performed batch reactions, varying temperature and oxygen pressure, and used the data to construct a predictive microkinetic model. As it turned out, AuPt/ZrO2 showed the highest selectivity, yielding 32 % of GA at 100 °C and 30 barg O2. Our results provide valuable insights for the developing of efficient catalysts and point out the bottlenecks for the oxidation of glucose to GA.
Keywords:glucaric acid, glucose oxidation, catalyst characterization, density functional theory, microkinetic modelling
Publication status:Published
Publication version:Version of Record
Publication date:01.04.2024
Publisher:Elsevier
Year of publishing:2024
Number of pages:str. 1-15
Numbering:Vol. 343,, article no. 123455
Source:Applied Catalysis B: Environmental
PID:20.500.12556/DiRROS-17462 New window
UDC:66
ISSN on article:1873-3883
DOI:10.1016/j.apcatb.2023.123455 New window
COBISS.SI-ID:172057091 New window
Copyright:© 2023 The Authors. Published by Elsevier B.V.
Note:Nasl. z nasl. zaslona; Soavtorji iz Slovenije: Janvit Teržan, Ana Kroflič, Janez Zavašnik, Matej Huš, Miha Grilc, Blaž Likozar; Opis vira z dne 14. 11. 2023;
Publication date in DiRROS:06.12.2023
Views:216
Downloads:123
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Record is a part of a journal

Title:Applied catalysis. Environmental.
Publisher:Elsevier
ISSN:1873-3883
COBISS.SI-ID:101344003 New window

Document is financed by a project

Funder:Other - Other funder or multiple funders
Funding programme:Czech Science Foundation
Project number:21-48595L
Name:Katalytická přeměna zbytkové biomasy na kyselinu glukarovou. Od víceúrovňového modelování až k sestavení funkčního reaktoru

Funder:ARRS - Slovenian Research Agency
Project number:J2-4424
Name:Celostni pristop za ohranjanje stenskih poslikav kulturne dediščine

Funder:ARRS - Slovenian Research Agency
Project number:I0-0039
Name:Gibanje znanost mladini (IP GZM)

Funder:ARRS - Slovenian Research Agency
Project number:P2-0421
Name:Trajnostne tehnologije in krožno gospodarstvo

Funder:ARRS - Slovenian Research Agency
Project number:P2-0152
Name:Kemijsko reakcijsko inženirstvo

Funder:ARRS - Slovenian Research Agency
Project number:J7-4638
Name:Načrtovanje selektivnih katalitskih postopkov pretvorbe CO2 v etanol – UliSess

Funder:ARRS - Slovenian Research Agency
Project number:J1-3028
Name:Večnivojsko modeliranje fotokatalitske CO2 redukcije z računalniško intenzivnimi simulacijami (multiPHOCOS)

Funder:ARRS - Slovenian Research Agency
Project number:J1-3020
Name:Uporaba odpadne biomase za katalitično pretvorbo v glukarno kislno: od večnivojskega reakcijskega modeliranja do reaktorske proizvodnje

Funder:ARRS - Slovenian Research Agency
Project number:N2-0242
Name:Elektrifikacija biorafinerij z indukcijsko-greto katalitsko pretvorbo bioosnovanih aromatov

Funder:ARRS - Slovenian Research Agency
Project number:NC-0024
Name:Pretvorba mikroalgne boimase v ogljikove hidrate, biogoriva in energijo – CaMBio

Funder:ARRS - Slovenian Research Agency
Project number:J2-2492
Name:Razvoj procesov valorizacije lignina kot vira aromatskih gradnikov za proizvodnjo bio-osnovanih polimerov

Licences

License:CC BY-NC-ND 4.0, Creative Commons Attribution-NonCommercial-NoDerivatives 4.0 International
Link:http://creativecommons.org/licenses/by-nc-nd/4.0/
Description:The most restrictive Creative Commons license. This only allows people to download and share the work for no commercial gain and for no other purposes.

Secondary language

Language:Slovenian
Title:Selective glucose oxidation to glucaric acid using bimetallic catalysts : lattice expansion or electronic structure effect
Keywords:kemijska tehnologija, glukoza, katalizatorji, teorija gostotnih funkcionalov, DFT


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