Additive Effects of LiBH<sub>4</sub> and ZrCoH<sub>3</sub> on the Hydrogen Sorption of the Li-Mg-N‑H Hydrogen Storage System

Abstract

LiBH<sub>4</sub> is an effective catalyst for the hydrogen sorption of the Li-Mg-N-H storage system. A combination of LiBH<sub>4</sub> with ZrCoH<sub>3</sub> was reported to be catalytically more effective. In this work, materials doped with LiBH<sub>4</sub> or ZrCoH<sub>3</sub> or a combination of ZrCoH<sub>3</sub> and LiBH<sub>4</sub> were characterized both in the as-prepared and in the cycled states. A comparison of the metathesis conversion, thermal behavior, kinetics, and phase evolution induced by H<sub>2</sub> cycling suggests that the two components function additively. While LiBH<sub>4</sub> facilitates the metathesis conversion in the first cycle and enhances kinetics during H<sub>2</sub> cycling by forming a quaternary complex hydride, ZrCoH<sub>3</sub> has at least a pulverizing effect in the material. The chemical environment and near order of the individual atoms of Zr and Co as well as the structural parameters of ZrCoH<sub>3</sub> were investigated by X-ray absorption and found to be unchanged during H<sub>2</sub> cycling

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