YS₂ monolayer as a high-efficient anode material for rechargeable Li-ion and Na-ion batteries

Computational Design of Novel Hydrogen-Rich YS–H Compounds

Prediction of the Reactivity of Argon with Xenon under High Pressures

Exploring high-pressure iron boride compounds: Structural electronics and mechanical properties

Prediction, and physic-chemical properties of (TiO₂)_n n = 15–20 clusters and their possible catalytic application: A DFT study

Superconductivity at 23 K in MgLi compound at ultrahigh pressure

Pressure-induced novel metallic phase in non-stoichiometric cadmium selenides: A first-principles study

New modulated structures of solid bromine at high pressure

High-pressure stable phases in mercury azide

First-principle study of the microstructure and electronic properties for Cr₃₊ doped yttrium orthoaluminate