Article ID Journal Published Year Pages File Type
5383641 Chemical Physics Letters 2012 6 Pages PDF
Abstract
► The interaction of molecular hydrogen with halide anions is investigated with the aid of DFT calculations. ► The bromide anion has the ability to bind up to seven hydrogen molecules. ► QTAIM analyses reveal the presence of closed-shell interactions. ► Eco-friendly and low-cost materials for hydrogen storage are proposed.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Authors
,