Enhanced hydrogen sensing properties of graphene by introducing a mono-atom-vacancy

Royal Soc Chemistry
Publication Type:
Journal Article
Physical Chemistry Chemical Physics, 2013, 15 (48), pp. 21016 - 21022
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To facilitate the dissociative adsorption of H-2 molecules on pristine graphene, the addition of a mono-atom-vacancy to graphene is proposed. This leads to reduction of the dissociative energy barrier for a H-2 molecule on graphene from 3.097 to 0.805 eV
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