La<sub>0.2</sub>Sr<sub>0.25</sub>Ca<sub>0.45</sub>TiO<sub>3</sub> Surface Reactivity with H<sub>2</sub>: A Combined <i>Operando</i> NEXAFS and Computational Study

A-site doped SrTiO<sub>3</sub> is considered as a promising substitute for traditional anodic metals in solid oxide fuel cells (SOFCs). In this study, we present the reactivity of La<sub>0.2</sub>Sr<sub>0.25</sub>Ca<sub>0.45</sub>TiO<sub>3</sub> (LCSTO), La<sub>0.2</sub>Sr<sub>0.7</sub>TiO<sub>3</sub> (LSTO), and SrTiO<sub>3</sub> (STO) toward H<sub>2</sub> by <i>operando</i> ambient pressure NEXAFS spectroscopy and theoretical spectra simulation with FDMNES code. The samples were synthesized by MBE (molecular beam epitaxy), hydrothermal, and modified-Pechini routes. We found that the reducibility of the samples depends not only on their stoichiometry but also on the morphology, which is determined by the synthetic method. The results of these experiments give insight into the reducibility of Ti<sup>4+</sup> in perovskites as well as the opportunity to further optimize the synthesis of these materials to obtain the best performance for SOFC applications.

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Publication Details

Journal
The Journal of Physical Chemistry Letters
Published
2024-08-13
DOI
https://doi.org/10.1021/acs.jpclett.4c01900
Citations
2
Primary Topic
Advancements in Solid Oxide Fuel Cells
Type
article
Field-Weighted Citation Impact
0.23

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article

La0.2Sr0.25Ca0.45TiO3 Surface Reactivity with H2: A Combined Operando NEXAFS and Computational Study

P. D’Angelo, Edvard Dobovičnik, Francesco Tavani, Pilar Ferrer et al.
2 citations
The Journal of Physical Chemistry Letters
Advancements in Solid Oxide Fuel Cells
0.23
article

La0.2Sr0.25Ca0.45TiO3 Surface Reactivity with H2: A Combined Operando NEXAFS and Computational Study

P. D’Angelo, Edvard Dobovičnik, Francesco Tavani, Pilar Ferrer, David Charles Grinter, Alessandro Tofoni, Georg Held, Ferdinando Bassato, Piero Torelli, Silvia Mauri, Luca Braglia, A. Yu. Petrov
article en
2 citations

Abstract

A-site doped SrTiO<sub>3</sub> is considered as a promising substitute for traditional anodic metals in solid oxide fuel cells (SOFCs). In this study, we present the reactivity of La<sub>0.2</sub>Sr<sub>0.25</sub>Ca<sub>0.45</sub>TiO<sub>3</sub> (LCSTO), La<sub>0.2</sub>Sr<sub>0.7</sub>TiO<sub>3</sub> (LSTO), and SrTiO<sub>3</sub> (STO) toward H<sub>2</sub> by <i>operando</i> ambient pressure NEXAFS spectroscopy and theoretical spectra simulation with FDMNES code. The samples were synthesized by MBE (molecular beam epitaxy), hydrothermal, and modified-Pechini routes. We found that the reducibility of the samples depends not only on their stoichiometry but also on the morphology, which is determined by the synthetic method. The results of these experiments give insight into the reducibility of Ti<sup>4+</sup> in perovskites as well as the opportunity to further optimize the synthesis of these materials to obtain the best performance for SOFC applications.

The Journal of Physical Chemistry LettersVol. 15(33)
University of Trieste (IT), Diamond Light Source (GB), Istituto Officina dei Materiali (IT), Sapienza University of Rome (IT)
Ministero dell’Istruzione, dell’Università e della Ricerca
Openalex Percentile: Top 52%
Advancements in Solid Oxide Fuel Cells
0.23
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