The synthesis the bulk VX225, recent phonon procedures are flexible dispersion calculations faolrsootrheveeraVl Xth2astumchonaoslVaySeer2 and VX2 Se In this work, we systematically investigate the electronic structures of monolayer and Te) in the 2H-phase based on the generalized gradient ...
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2. Methods The structural relaxations and total energy calculations were performed using the projector augmented wave (PAW) method [25] based on the density functional theory (DFT) [26] by using Vienna ab initio simulation package code. The scheme of Perdew–Burke–Ernzerhof (PBE) was employed ...
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