N-GDY with dispersed Li/Na/K/Ca dopants achieves 9.15-13.08 wt% intrinsic H2 capacity with reversible near-ambient adsorption per DFT, AIMD and Langmuir modeling.
Vanadium -decorated 2D polyaramid material for high -capacity hydrogen storage: Insights from DFT simulations,
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N-Graphdiyne as a Tunable Platform for Stabilizing Light Metals toward High-Capacity Reversible Hydrogen Storage
N-GDY with dispersed Li/Na/K/Ca dopants achieves 9.15-13.08 wt% intrinsic H2 capacity with reversible near-ambient adsorption per DFT, AIMD and Langmuir modeling.