Dissociation of H2 on Mg-coated B12C6N6

Dissociation of H₂ on Mg-coated B₁₂C₆N₆

Ma Li, Jin Xue-Ling, Yang Hui-Hui, Wang Xiao-Xia, Du Ning, Chen Hong-Shan^†

(color online) Optimized configurations of Mg-coated B₁₂C₆N₆Mg_n. The preferred binding sites for Mg atom are the B₂C₂ rings.