Exploring the structural, hydrogen storage capacity, dehydrogenation behavior, mechanical, electronic and optical properties of Ti–H hydrides for hydrogen storage

Key Points

• Ti–H hydrides exhibit notable hydrogen storage capacity, essential for energy applications.
• The dehydrogenation behavior indicates efficient energy release through chemical processes.
• Assessment involved evaluating structural, mechanical, electronic, and optical properties of hydrides.
• Insights could advance hydrogen storage technologies, highlighting the importance of titanium-based materials.