Uncovering the Effect of Al Addition on the Hydrogen Storage Properties of the Ternary TiVNb Alloy.

The effect of Al addition on the structure, microstructure and hydrogen storage properties of the ternary TiVNb alloy was investigated from small amounts to equimolar composition. Alx(TiVNb)1-x (x = 0.05, 0.175 and 0.25) alloys are bcc single-phase materials with decreasing lattice parameters with increasing Al content. Al addition progressively decreases the hydrogen storage capacity but also destabilizes fcc dihydride formation for alloys with x ≤ 0.10. Among the different compositions, the most promising alloy was found to be that with x = 0.05 Al content that exhibited high initial storage capacity (2.96 wt.%), a less stable hydride (ΔH = -52 kJ/mol H2 and ΔS = -141 J/K∙mol H2), better desorption properties (desorption onset temperature around 100 °C) and enhanced reversible capacity during cycling (2.83 wt.%) compared to the ternary TiVNb. In situ and ex situ synchrotron X-ray powder diffraction, together with thermal desorption experiments, showed improved desorption properties with Al addition, together with a two-step reaction with hydrogen. These findings highlight the use of small quantities of lightweight Al in refractory multi-principal element alloys as a promising approach for enhancing the solid-state hydrogen storage performance of bcc-type alloys.