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    • A First-Principles Study of Sodium Adsorption and Diffusion on Phosphorene 

      Liu, Xiao; Wen, Yanwei; Chen, Zhengzheng; Shan, Bin; Chen, Rong
      The structural, electronic, electrochemical as well as diffusion properties of Na doped phosphorene have been investigated based on first-principles calculations. The strong binding energy between Na and phosphorene indicates ...