Scatter Plot from Scientific Research

Convex hull analysis for a concentration of H 2 from zero to 1.33 H 2 per -Mg(BH 4 ) 2 . The DFT energies refer to the empty framework -Mg(BH 4 ) 2 and -Mg(BH 4 ) 2 1.33H 2 . Blue and purple crosses represent configurations of -Mg(BH 4 ) 2 x H 2 with adsorption on the D11 and D22 sites, respectively. The y axis represents the energy per -Mg(BH 4 ) 2 formula unit (f.u.).

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