Chemical Reviews, volume 120, issue 2, pages 814-850
Well-Defined Nanoparticle Electrocatalysts for the Refinement of Theory.
1
Department of Chemistry and Texas Materials Institute, The University of Texas at Austin, 105 East 24th Street, Stop A5300, Austin, Texas 78712-1224, United States
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Publication type: Journal Article
Publication date: 2019-10-28
Journal:
Chemical Reviews
Quartile SCImago
Q1
Quartile WOS
Q1
Impact factor: 62.1
ISSN: 00092665, 15206890
General Chemistry
Abstract
The relationship between experiment and theory in electrocatalysis is one of profound importance. Until fairly recently, the principal role of theory in this field was interpreting experimental results. Over the course of the past decade (roughly the period covered by this review), however, that has begun to change, with theory now frequently leading the design of electrocatalytic materials. Though rewarding, this has not been a particularly easy union. For one thing, experimentalists and theorists have to come to grips with the fact that they rely on different models. Theorists make predictions based on individual, perfect structural models, while experimentalists work with more complex and heterogeneous ensembles of electrocatalysts. As discussed in this review, computational capabilities have improved in recent years, so that theory is better represented by the structures that experimentalists are able to prepare. Likewise, synthetic chemists are able to make ever more complex electrocatalysts with high levels of control, which provide a more extensive palette of materials for testing theory. The goal of this review is to highlight research from the last ∼10 years that focuses on carefully controlled electrocatalytic experiments which, in combination with theoretical predictions, bring us closer to bridging the gap between real catalysts and computational models.
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1 publication, 1.39%
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1 publication, 1.39%
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5
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25
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- We do not take into account publications that without a DOI.
- Statistics recalculated only for publications connected to researchers, organizations and labs registered on the platform.
- Statistics recalculated weekly.
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Trindell J. A. et al. Well-Defined Nanoparticle Electrocatalysts for the Refinement of Theory. // Chemical Reviews. 2019. Vol. 120. No. 2. pp. 814-850.
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Trindell J. A., Duan Z., Henkelman G., Crooks R. M. Well-Defined Nanoparticle Electrocatalysts for the Refinement of Theory. // Chemical Reviews. 2019. Vol. 120. No. 2. pp. 814-850.
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TY - JOUR
DO - 10.1021/acs.chemrev.9b00246
UR - https://doi.org/10.1021%2Facs.chemrev.9b00246
TI - Well-Defined Nanoparticle Electrocatalysts for the Refinement of Theory.
T2 - Chemical Reviews
AU - Duan, Zhiyao
AU - Henkelman, Graeme
AU - Crooks, Richard M.
AU - Trindell, Jamie Allyce
PY - 2019
DA - 2019/10/28 00:00:00
PB - American Chemical Society (ACS)
SP - 814-850
IS - 2
VL - 120
SN - 0009-2665
SN - 1520-6890
ER -
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@article{2019_Trindell,
author = {Zhiyao Duan and Graeme Henkelman and Richard M. Crooks and Jamie Allyce Trindell},
title = {Well-Defined Nanoparticle Electrocatalysts for the Refinement of Theory.},
journal = {Chemical Reviews},
year = {2019},
volume = {120},
publisher = {American Chemical Society (ACS)},
month = {oct},
url = {https://doi.org/10.1021%2Facs.chemrev.9b00246},
number = {2},
pages = {814--850},
doi = {10.1021/acs.chemrev.9b00246}
}
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MLA
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Trindell, Jamie Allyce, et al. “Well-Defined Nanoparticle Electrocatalysts for the Refinement of Theory..” Chemical Reviews, vol. 120, no. 2, Oct. 2019, pp. 814-850. https://doi.org/10.1021%2Facs.chemrev.9b00246.
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