A Hypervalent and Cubically Coordinated Molecular Phase of IF₈ Predicted at High Pressure

Glide Mirror Plane Protected Nodal-Loop in Anisotropic Half-Metallic MnNF Monolayer

Probing the Structural and Electronic Properties of Neutral and Anionic Lanthanum-Doped Silicon Clusters

Spontaneous Decomposition of Fluorinated Phosphorene and Its Stable Structure

Predicting Novel 2D MB2 (M = Ti, Hf, V, Nb, Ta) Monolayers with Ultrafast Dirac Transport Channel and Electron-Orbital Controlled Negative Poisson's Ratio

High-Temperature Ferromagnetism in Fe₃P Monolayer with a Large Magnetic Anisotropy

Exotic Hydrogen Bonding in Compressed Ammonia Hydrides

Two-Dimensional Gold Sulfide Monolayers with Direct Band Gap and Ultrahigh Electron Mobility

Hard BN Clathrate Superconductors

Decomposition and Recombination of Binary Interalkali Na₂K at High Pressures