Tunable eg Orbital Occupancy in Heusler Compounds for Oxygen Evolution Reaction**

Yu M, Li G, Fu C, Liu E, Manna K, Budiyanto E, Yang Q, Felser C, Tuysuz H (2021)

Publication Type: Journal article

Publication year: 2021

Journal

Angewandte Chemie International Edition Wiley

Book Volume: 60

Pages Range: 5800-5805

Journal Issue: 11

DOI: 10.1002/anie.202013610

Abstract

Heusler compounds have potential in electrocatalysis because of their mechanical robustness, metallic conductivity, and wide tunability in the electronic structure and element compositions. This study reports the first application of Co2YZ-type Heusler compounds as electrocatalysts for the oxygen evolution reaction (OER). A range of Co2YZ crystals was synthesized through the arc-melting method and the eg orbital filling of Co was precisely regulated by varying Y and Z sites of the compound. A correlation between the eg orbital filling of reactive Co sites and OER activity was found for Co2MnZ compounds (Z=Ti, Al, V, and Ga), whereby higher catalytic current was achieved for eg orbital filling approaching unity. A similar trend of eg orbital filling on the reactivity of cobalt sites was also observed for other Heusler compounds (Co2VZ, Z=Sn and Ga). This work demonstrates proof of concept in the application of Heusler compounds as a new class of OER electrocatalysts, and the influence of the manipulation of the spin orbitals on their catalytic performance.

Involved external institutions

Max-Planck-Institut für Kohlenforschung (MPI KoFo) / Max Planck Institute for Coal Research DE Germany (DE) Max-Planck-Institut für Chemische Physik fester Stoffe (MPI CPfS) / Max Planck Institute for Chemical Physics of Solids DE Germany (DE)

How to cite

APA:

Yu, M., Li, G., Fu, C., Liu, E., Manna, K., Budiyanto, E.,... Tuysuz, H. (2021). Tunable eg Orbital Occupancy in Heusler Compounds for Oxygen Evolution Reaction**. Angewandte Chemie International Edition, 60(11), 5800-5805. https://doi.org/10.1002/anie.202013610

MLA:

Yu, Mingquan, et al. "Tunable eg Orbital Occupancy in Heusler Compounds for Oxygen Evolution Reaction**." Angewandte Chemie International Edition 60.11 (2021): 5800-5805.

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