The review focuses on various hydrogen producing and storing methods that can be
employed for creating a hydrogen economy. The latest advancements that have been made …

Hydrogen as a clean fuel is becoming vital in view of depleting fossil fuels and ever
increasing energy demand. Hence hydrogen generation and storage gains immense …

The newly found B40 is the first experimentally observed all-boron fullerene and has
potential applications in hydrogen storage. Here we investigate the binding ability and …

We investigate the feasibility of bare and metal-coated boron buckyball B80 with M= Li, Na,
K, Be, Mg, Ca, Sc, Ti, and V for hydrogen storage using density functional theory approach …

Intermolecular interactions between the CO 2 molecule and a range of functionalized
aromatic molecules have been investigated using density functional theory. The work is …

Porous metal–graphyne framework (MGF) made up of graphyne linker decorated with
lithium has been investigated for hydrogen storage. Applying density functional theory spin …

Transition-metal (TM) boride and carboride nanostructures are studied as model
organometallic materials for hydrogen storage. The dispersed TM atoms function as H2 …

Hydrogen (H2) has the ability to be a future green-energy source for the automotive industry
due to its versatility, clean nature, and efficiency as an energy carrier. The biggest obstacle …

The most stable H 2 adsorption on pure covalent organic frameworks (COFs) occurs near O
atoms, but its binding energy (∼ 0.05 eV) is not sufficient to satisfy the minimum value (0.24 …

An all-electron scalar relativistic calculation on the adsorption of hydrogen molecule onto
small copper clusters has been performed by using density functional theory with the …