Effect of the Addition of 4 wt% Zr to BCC Solid Solution Ti52V12Cr36 at Melting/Milling on Hydrogen Sorption Properties

The addition of 4 wt% Zr to Ti52V12Cr36 alloy was carried out in two different ways: arc-melting or ball-milling. The cast alloy showed rapid hydrogen absorption up to 3.6 wt% of hydrogen capacity within 15 min. Ball milling this sample worsened the kinetics, and no hydrogen absorption was registered when milling was carried out for 30 or 60 min. When zirconium is added by ball-milling, the kinetic is slower than that when addition is by arc-melting. This is due to the fact that when added by milling, zirconium does not form a ternary phase with Ti, V, and Cr but instead is just dispersed on the particles’ surface.

Titanium Hydride Nanoplates Enable 5 wt% of Reversible Hydrogen Storage by Sodium Alanate below 80°C

Sodium alanate (NaAlH4) with 5.6 wt% of hydrogen capacity suffers seriously from the sluggish kinetics for reversible hydrogen storage. Ti-based dopants such as TiCl4, TiCl3, TiF3, and TiO2 are prominent in enhancing the dehydrogenation kinetics and hence reducing the operation temperature. The tradeoff, however, is a considerable decrease of the reversible hydrogen capacity, which largely lowers the practical value of NaAlH4. Here, we successfully synthesized a new Ti-dopant, i.e., TiH2 as nanoplates with ~50 nm in lateral size and ~15 nm in thickness by an ultrasound-driven metathesis reaction between TiCl4 and LiH in THF with graphene as supports (denoted as NP-TiH2@G). Doping of 7 wt% NP-TiH2@G enables a full dehydrogenation of NaAlH4 at 80°C and rehydrogenation at 30°C under 100 atm H2 with a reversible hydrogen capacity of 5 wt%, superior to all literature results reported so far. This indicates that nanostructured TiH2 is much more effective than Ti-dopants in improving the hydrogen storage performance of NaAlH4. Our finding not only pushes the practical application of NaAlH4 forward greatly but also opens up new opportunities to tailor the kinetics with the minimal capacity loss.

RESEARCH OF THE KINETICS OF THE FIRST HYDRATION OF MATERIAL TIFE + TI2FE, OBTAINED BY EXPLOSIVE LOADING OF MIXTURES OF TITANIUM AND IRON POWDERS

The kinetics of the processes of primary hydrogenation of material based on TiFe obtained by explosive pressing of titanium and iron powders with subsequent heat treatment has been investigated. Using the results obtained and mathematical processing of the curves using the Avraami-Erofeev equation, it was revealed that the mechanism of their saturation with hydrogen corresponds to the classical concepts of reaction diffusion. The process begins with the formation of a layer of solid solutions of hydrogen on the surface of the material in the initial phases of the material and after the latent period continues with the formation of a layer of hydride phases. t is shown that the hydrogen storage material TiFe + TiFe has a significantly higher hydrogen capacity than single-phase TiFe.

The Structural, Elastic, Electronic, Vibrational and Gravimetric Hydrogen Capacity Properties of the Perovskite Type Hydrides: DFT Study

The structural, elastic, anisotropic elastic, electronic, vibrational and properties of the Perovskite type Hydrides RbXH3 (X = Be, Ca, Mg) were performed via Vienna Ab – initio Simulation Pac-kage (VASP) based on Density Functional Theory (DFT). Our results have exhibited a well-agreement with previous calculations and experiments for each compound. In order to de-termine physical properties of RbXH3 has been used the Generalized Gradient Approximation (GGA) with Perdew-Burke-Ernzerhof (PBE) functional at this study. Present compounds were found to be mechanically stable as well as their gravimetric hydrogen storage capacities has been investigated. The Perovskite type Hydrides RbBeH3 and RbMgH3 has an indirect bandgap of 0.274 eV and 2.209 eV while RbCaH3 has a direct bandgap of 3.274 eV respectively and therefo-re these compounds has shown a semiconductor behaviour at equilibrium. Besides directional dependence of anisotropic properties was visualized by representing them with maximum - mi-nimum points..

Effect of HPT on the First Hydrogenation of LaNi5 Metal Hydride

This paper reports the effect of high-pressure torsion (HPT) on the first hydrogenation of LaNi5. We found that, for loose powder, reduction of particle size has an effect of increasing the incubation time and decreasing the hydrogen capacity. A higher amount of HPT turns only marginally reduce the incubation time but has no effect on hydrogen capacity. In all cases, the first dehydrogenation and subsequent hydrogenation have the same kinetics, irrespective of the particle size or number of HPT turns. Therefore, for LaNi5, HPT has a beneficial effect only for the first hydrogenation.

Co-Addition of Mg2Si and Graphene for Synergistically Improving the Hydrogen Storage Properties of Mg−Li Alloy

Mg−Li alloy possesses a high hydrogen capacity. However, the hydrogenation and dehydrogenation performances are still far from practical application. In this work, Mg2Si (MS) and graphene (G) were employed together to synergistically improve the hydrogen storage properties of Mg−Li alloy. The structures of the samples were studied by XRD and SEM methods. The hydrogen storage performances of the samples were studied by nonisothermal and isothermal hydrogenation and dehydrogenation, thermal analysis, respectively. It is shown that the onset dehydrogenation temperature of Mg−Li alloy was synergistically reduced from 360°C to 310°C after co-addition of Mg2Si and graphene. At a constant temperature of 325°C, the Mg−Li−MS−G composite can release 2.7 wt.% of hydrogen within 2 h, while only 0.2 wt.% of hydrogen is released for the undoped Mg−Li alloy. The hydrogenation activation energy of the Mg−Li−MS−G composite was calculated to be 86.5 kJ mol−1. Microstructure and hydrogen storage properties studies show that graphene can act as a grinding aid during the ball milling process, which leads to a smaller particle size for the composites. This work demonstrates that coaddition of Mg2Si and graphene can synergistically improve the hydrogen storage properties of Mg−Si alloy and offers an insight into the role of graphene in the Mg−Li−MS−G composite.

Hydrolytic Dehydrogenation of Ammonia Borane Attained by Ru-Based Catalysts: An Auspicious Option to Produce Hydrogen from a Solid Hydrogen Carrier Molecule

Chemical hydrogen storage stands as a promising option to conventional storage methods. There are numerous hydrogen carrier molecules that afford satisfactory hydrogen capacity. Among them, ammonia borane has attracted great interest due to its high hydrogen capacity. Great efforts have been devoted to design and develop suitable catalysts to boost the production of hydrogen from ammonia borane, which is preferably attained by Ru catalysts. The present review summarizes some of the recent Ru-based heterogeneous catalysts applied in the hydrolytic dehydrogenation of ammonia borane, paying particular attention to those supported on carbon materials and oxides.