Structural, mechanical, and electronic properties of 25 kinds of <i>III</i>–<i>V</i> binary monolayers: A computational study with first-principles calculation

Structural, mechanical, and electronic properties of 25 kinds of III–V binary monolayers: A computational study with first-principles calculation

Liu Xue-Fei^{1, 2, 3}, Luo Zi-Jiang^{1, 2, 4}, Zhou Xun³, Wei Jie-Min^{1, 2, 5}, Wang Yi^{1, 2}, Guo Xiang^{1, 2}, Lv Bing³, Ding Zhao^{1, 2, †}

Top (left) and side (right) view of template structure (AlBi) used in this paper, with lattice constant denoting as a and b (a = b), and l, Δ , and θ representing bond length, buckling constant, and bond angle respectively.