A new hard phase of ReB4 predicted from first principles

Prediction of a Superhard Material: B₄C₄

Universal ground state hexagonal phases and mechanical properties of stoichiometric transition metal tetraborides: TMB4 (TM = W, Tc, and Re)

Pressure-induced polymerization of nitrogen in potassium azides

Novel high-pressure phase with pseudo-benzene

Structural and electronic properties of sodium azide at high pressure: A first principles study

Structural and electronic properties of BaCrO₄ at high-pressures

Tuning the physical properties of antiferromagnetic perovskite oxide NiCrO₃ by high-pressure from density-functional calculations

Predicted crystal structures of molybdenum under high pressure

Ground-state structure determination and mechanical properties of palladium seminitride