Novel high-pressure structure and superconductivity of titanium trisulfide

Prediction of Li₂B novel phases and superconductivity under varying pressures

New high pressure phase of yttrium metal under ultrahigh pressure

New predicted ground state and high pressure phases of TcB₃ and TcB₄: First-principles

Crystal structures of CsSi₆ at high pressures

Theoretical exploring the mechanical and electrical properties of tI12-B₆C₄₀₂

Predicting two-dimensional carbon phosphide compouds: C₂P₄ by the global optimization method

Structural evolution and properties of small-size thiol-protected gold nanoclusters

An insight into the structures, stabilities and magnetic properties of Fe₂B_n (n= 1–10) clusters

The pressure-induced chemical structures and properties trend for compressed iron-boride compounds