Bragg Coherent Diffraction Imaging for In Situ Studies in Electrocatalysis
Abstract
Electrocatalysis is at the heart of a broad range of physicochemical applications that play an important role in the present and future of a sustainable economy. Among the myriad of different electrocatalysts used in this field, nanomaterials are of ubiquitous importance. An increased surface area/volume ratio compared to bulk makes nanoscale catalysts the preferred choice to perform electrocatalytic reactions. Bragg coherent diffraction imaging (BCDI) was introduced in 2006 and since has been applied to obtain 3D images of crystalline nanomaterials. BCDI provides information about the displacement field, which is directly related to strain. Lattice strain in the catalysts impacts their electronic configuration and, consequently, their binding energy with reaction intermediates. Even though there have been significant improvements since its birth, the fact that the experiments can only be performed at synchrotron facilities and its relatively low resolution to date (~10 nm spatial resolution) have prevented the popularization of this technique. Herein, we will briefly describe the fundamentals of the technique, including the electrocatalysis relevant information that we can extract from it. Subsequently, we review some of the computational experiments that complement the BCDI data for enhanced information extraction and improved understanding of the underlying nanoscale electrocatalytic processes. We next highlightmore »
- Authors:
-
[3];
[4];
[1]
- Univ. of Campinas (UNICAMP), Sao Paulo (Brazil)
- Brazilian Center for Research in Energy and Materials (CNPEM), Campinas, SP (Brazil)
- Univ. of Illinois, Chicago, IL (United States). Dept. of Mechanical and Industrial Engineering; Argonne National Lab. (ANL), Argonne, IL (United States)
- Univ. of Alicante (Spain). Inst. of Electrochemistry
- Publication Date:
- Research Org.:
- Argonne National Laboratory (ANL), Argonne, IL (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES). Chemical Sciences, Geosciences & Biosciences Division
- OSTI Identifier:
- 1815533
- Grant/Contract Number:
- AC02-06CH11357
- Resource Type:
- Accepted Manuscript
- Journal Name:
- ACS Nano
- Additional Journal Information:
- Journal Volume: 15; Journal Issue: 4; Journal ID: ISSN 1936-0851
- Publisher:
- American Chemical Society (ACS)
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY; Bragg coherent diffraction imaging; electrochemistry; electrocatalysis; strain; in situ experiments; X-ray diffraction; fourth-generation synchrotron; computational experiments; single-nanoparticle experiments
Citation Formats
Vicente, Rafael A., Neckel, Itamar T., Sankaranarayanan, Subramanian K. R. S., Solla-Gullon, José, and Fernández, Pablo S. Bragg Coherent Diffraction Imaging for In Situ Studies in Electrocatalysis. United States: N. p., 2021.
Web. doi:10.1021/acsnano.1c01080.
Vicente, Rafael A., Neckel, Itamar T., Sankaranarayanan, Subramanian K. R. S., Solla-Gullon, José, & Fernández, Pablo S. Bragg Coherent Diffraction Imaging for In Situ Studies in Electrocatalysis. United States. https://doi.org/10.1021/acsnano.1c01080
Vicente, Rafael A., Neckel, Itamar T., Sankaranarayanan, Subramanian K. R. S., Solla-Gullon, José, and Fernández, Pablo S. Thu .
"Bragg Coherent Diffraction Imaging for In Situ Studies in Electrocatalysis". United States. https://doi.org/10.1021/acsnano.1c01080. https://www.osti.gov/servlets/purl/1815533.
@article{osti_1815533,
title = {Bragg Coherent Diffraction Imaging for In Situ Studies in Electrocatalysis},
author = {Vicente, Rafael A. and Neckel, Itamar T. and Sankaranarayanan, Subramanian K. R. S. and Solla-Gullon, José and Fernández, Pablo S.},
abstractNote = {Electrocatalysis is at the heart of a broad range of physicochemical applications that play an important role in the present and future of a sustainable economy. Among the myriad of different electrocatalysts used in this field, nanomaterials are of ubiquitous importance. An increased surface area/volume ratio compared to bulk makes nanoscale catalysts the preferred choice to perform electrocatalytic reactions. Bragg coherent diffraction imaging (BCDI) was introduced in 2006 and since has been applied to obtain 3D images of crystalline nanomaterials. BCDI provides information about the displacement field, which is directly related to strain. Lattice strain in the catalysts impacts their electronic configuration and, consequently, their binding energy with reaction intermediates. Even though there have been significant improvements since its birth, the fact that the experiments can only be performed at synchrotron facilities and its relatively low resolution to date (~10 nm spatial resolution) have prevented the popularization of this technique. Herein, we will briefly describe the fundamentals of the technique, including the electrocatalysis relevant information that we can extract from it. Subsequently, we review some of the computational experiments that complement the BCDI data for enhanced information extraction and improved understanding of the underlying nanoscale electrocatalytic processes. We next highlight success stories of BCDI applied to different electrochemical systems and in heterogeneous catalysis to show how the technique can contribute to future studies in electrocatalysis. Finally, we outline current challenges in spatiotemporal resolution limits of BCDI and provide our perspectives on recent developments in synchrotron facilities as well as the role of machine learning and artificial intelligence in addressing them.},
doi = {10.1021/acsnano.1c01080},
journal = {ACS Nano},
number = 4,
volume = 15,
place = {United States},
year = {Thu Apr 01 00:00:00 EDT 2021},
month = {Thu Apr 01 00:00:00 EDT 2021}
}
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