Pressure-dependent DFT study of A2LuCuH6 (A = Li, Na, K) hydrides for hydrogen storage and photo-catalytic water splitting applications
Next-generation clean-energy technologies seek efficient solid-state energy storage materials for hydrogen-based energy systems that exhibit thermodynamically stable properties and multifunctional optoelectronic performance. In the current article, the structural, hydrogen-storage, mechanical, electronic, optical,...