A Tailored Ti‐Based Rutile‐Type High‐Entropy Oxide: Unlocking Ultrafast De/Hydrogenation Kinetics of MgH 2 via Multimetallic Synergism

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Authors: Xue Ke, Yang Zhang, Fulai Qi, Qian Zhang, Xinqiang Wang, Yanxia Liu, Ke Wang, Jindou Shi, Zichao Shen, Mingchang Zhang, Yufeng Yang, Yufeng Yang
+8 more Fan Gao, Wengang Cui, Zhenglong Li, Yufeng Yang, Yufeng Yang, Lixian Sun, J. F. Chen, Hongge Pan
Cited by: 7
References: 57

Abstract

ABSTRACT Magnesium hydride (MgH 2 ) is widely regarded as a highly promising solid‐state hydrogen storage material. However, its practical application is severely constrained by high operating temperatures and sluggish hydrogen absorption/desorption kinetics arising from multistep reaction energy barriers. Here, we rationally tailor a quinary Ti‐based rutile‐type high‐entropy oxide to overcome these intrinsic limitations for the first time. The onset dehydrogenation temperature of the hybrid reduces to 195°C, which is 163°C lower than that of pristine MgH 2 . The composite releases 5.88 wt.% H 2 within 10 min at 250°C, accompanied by a 58% reduction in the apparent dehydrogenation activation energy. Moreover, a 1.84 wt.% H 2 uptake can be achieved within only 20 s at room temperature. The coexistence of various multivalent metal cations, lattice distortions, abundant defects, and oxygen vacancies in (TiNbCrTaFe)O 2 substantially reduces the multi‐step reaction energy barriers during MgH 2 de/hydrogenation, enabling the overall kinetics to surpass those of all previously reported high‐entropy catalyst‐modified MgH 2 systems. This work expands the compositional design space and application scope of high‐entropy oxides and provides a viable strategy for advanced hydrogen storage and catalytic systems.

Fields of Study & Subjects

Hydrogen Storage and Materials Catalysts for Methane Reforming Thermal Expansion and Ionic Conductivity

Publication details

Journal / source
Advanced Energy Materials
Publisher
Wiley
Volume
16
Issue
20
Publication date
26 March 2026
Language
EN