tailieunhanh - First-principles study of electronic and optical properties and photocatalytic performance of MS monolayer under strain

The study explores the mechanical, optoelectrical and photocatalytic properties of GeS and SnS structures by Density Function Theory (DFT) through Quantum Espresso software. The results show that the GeS and SnS structures are the semiconductor materials at equilibrium with band gaps of eV and eV, respectively. |

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