Pressure-Induced Electronic and Structural Transition in Nodal-Line Semimetal ZrSiSe

Cobalt−Nitrogen Compounds at High Pressure

Semiconductor-to-metal transition in HfSe₂ under high pressure

Phase Transformation and Mechanical Stability of Niobium Aluminide (Nb₃Al) Induced by High Pressures

Prediction of stable BC₃N₂ monolayer from first-principles calculations: Stoichiometry, crystal structure, electronic and adsorption properties

Two-dimensional MgSiP₂ with anisotropic electronic properties and good performances for Na-ion batteries

Two-dimensional Pt₂P₃ monolayer: a promising bifunctional electrocatalyst with different active sites for hydrogen evolution and CO₂ reduction

Identification of octahedral coordinated ZrN₁₂⁺ cationic clusters by mass spectrometry and structure searches

First principles study of dense and metallic nitric sulfur hydrides

Orthorhombic C₃₆: a sp²–sp³ carbon with pressure-induced metallization and superconductivity