非铁层状双氢氧化物中纳米级磁有序的诱导:稳定自旋电子电催化

IF 12.1 2区 材料科学 Q1 CHEMISTRY, MULTIDISCIPLINARY
Small Pub Date : 2025-01-15 DOI:10.1002/smll.202412021
Sakshi Kansal, Rahul Ravindran, Alok Kumar Srivastava, Amreesh Chandra
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引用次数: 0

摘要

在有色金属层状双氢氧化物(LDHs)中诱导磁有序可以激发更高的自旋极化,从而提高析氧反应(OER)的效率。在纳米磁性材料中,拉长晶粒的概念在外加磁场的作用下驱动畴排列。因此,在固体电极界面附近,改进的磁流体动力学(MHD)对有色金属纳米催化剂的电催化能力有积极的影响。因此,即使使用较低的磁场,也可以显著改善水裂解动力学。在100高斯下,OER和析氢反应(HER)的过电位分别下降20%和10%。密度泛函理论(DFT)的计算也提出了解释热力学的HER/OER过程。结果表明,该工艺的吉布斯能可以降低钴等掺杂物的交换能垒。在HER和OER过程中,附加的钴金属活性位点对反应中间体的吸附概率最高,从而提高了效率。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Induction of Nanoscale Magnetic Ordering in Non-Ferrous Layered Double Hydroxides: Stabilizing Spintronic Electrocatalysis

Induction of Nanoscale Magnetic Ordering in Non-Ferrous Layered Double Hydroxides: Stabilizing Spintronic Electrocatalysis

Inducing magnetic ordering in a non-ferrous layered double hydroxides (LDHs) instigates higher spin polarization, which leads to enhanced efficiency during oxygen evolution reaction (OER). In nano-sized magnetic materials, the concept of elongated grains drives domain alignment under the application of an external magnetic field. Hence, near the solid electrode interface, modified magnetohydrodynamics (MHD) positively impacts the electrocatalytic ability of non-ferrous nanocatalysts. Consequently, significant improvement in the water-splitting kinetics can be obtained by using even low magnetic fields. At 100 Gauss, 20% and 10% decrement in the overpotential is reported for OER and hydrogen evolution reaction (HER), respectively. Density functional theory (DFT) calculations are also presented to explain the thermodynamics of the HER/OER processes. It is established that the Gibbs energy of the process can reduce the exchange energy barrier by using dopant like cobalt. The additional cobalt metal active site have the highest probability for adsorption of reactive intermediates during HER and OER, which results in higher efficiencies.

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来源期刊
Small
Small 工程技术-材料科学:综合
CiteScore
17.70
自引率
3.80%
发文量
1830
审稿时长
2.1 months
期刊介绍: Small serves as an exceptional platform for both experimental and theoretical studies in fundamental and applied interdisciplinary research at the nano- and microscale. The journal offers a compelling mix of peer-reviewed Research Articles, Reviews, Perspectives, and Comments. With a remarkable 2022 Journal Impact Factor of 13.3 (Journal Citation Reports from Clarivate Analytics, 2023), Small remains among the top multidisciplinary journals, covering a wide range of topics at the interface of materials science, chemistry, physics, engineering, medicine, and biology. Small's readership includes biochemists, biologists, biomedical scientists, chemists, engineers, information technologists, materials scientists, physicists, and theoreticians alike.
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