The Inorganic Crystal Structure Database (ICSD) is the world's largest database of fully
evaluated and published crystal structure data, mostly obtained from experimental results …

Titanium (Ti) and its alloys are attractive for a wide variety of structural and functional
applications owing to excellent specific strength, toughness and stiffness, and corrosion …

Hydrogen as a fuel can be stored safely with high volumetric density in metals. It can,
however, also be detrimental to metals, causing embrittlement. Understanding fundamental …

The elastic properties and mechanical stability of zirconium alloys and zirconium hydrides
have been investigated within the framework of density functional perturbation theory …

We used by in-situ high energy X-ray diffraction to investigate the deformation behavior of
Grade 2 commercially pure titanium that was hydrogen charged to form hydrides. The results …

Titanium tetra hydride is considered for hydrogen storage purposes. Firstly, formation
energy, hydrogen desorption temperature and gravimetric hydrogen density of TiH 4 is …

Various phases of TiH x (x= 1− 2) were constructed, with all possible H-atom configurations
being considered. The first-principles energetics calculations were performed to evaluate …

In this work we have studied transgranular cleavage and the fracture toughness of titanium
hydrides by means of quantum mechanical calculations based on density functional theory …

Hydride induced embrittlement is one of the main causes for the stress corrosion crack of
titanium alloys. The formation process of the hydride at atomic level remains controversial as …

Thermal desorption behaviours of titanium hydride powders under isothermal heat treatment
conditions were studied using simultaneous thermogravimetry and thermal desorption …