Computational Prediction of a Novel Superhard sp³ Trigonal Carbon Allotrope with Bandgap Larger than Diamond

A theoretical investigation of the crystal structure and electronic characters of trivalent Er³⁺ doped yttrium aluminum garnet

Experimental Observation and Energy Performance Calculations of Potential Oxidants O4−^/0 and O6^−/0 Clusters

High pressure phase stability, elastic anisotropy and electronic properties of BC₂N

Structural and bonding properties of Al_nC₄^−/0 (n = 2–4) clusters: Anion photoelectron spectroscopy and theoretical calculations

Electronic Properties, High Pressure Phase Stability and Elastic Anisotropy of BC₅

Carbon-boron clathrates as a new class of sp³-bonded framework materials

Pressure-stabilized divalent ozonide CaO₃ and its impact on Earth’s oxygen cycles

Xenon iron oxides predicted as potential Xe hosts in Earth’s lower mantle

Formation of ammonia–helium compounds at high pressure