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Published in 2019 at "Advanced Engineering Materials"
DOI: 10.1002/adem.201900027
Abstract: Magnesium hydride (MgH2) and titanium hydride (TiH2) are two potential candidates for solid‐state hydrogen storage, but strong hydride formation energy in these hydrides undesirably results in their high dehydrogenation temperature. First‐principles calculations show that the…
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Keywords:
system;
mgh2 tih2;
hydrogen;
hydrogen storage ... See more keywords
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Published in 2020 at "International Journal of Hydrogen Energy"
DOI: 10.1016/j.ijhydene.2020.05.141
Abstract: Abstract DFT calculations were carried out to investigate hydrogen release and diffusion behaviors. Results demonstrated that MgH2/TiH2 interface is thermodynamically stable with negative adhesion energy of −1.33 J/m2 with respect to the individual MgH2 and TiH2…
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Keywords:
dehydrogenation;
hydrogen;
mgh2;
mgh2 tih2 ... See more keywords