Electronic, mechanical and vibrational properties of a tubular tetragonal carbon

Predicting two-dimensional diphosphorus silicide monolayer by the global optimization method

Metallurgical Pyrolysis toward Co@Nitrogen-Doped Carbon Composite for Lithium Storage

Exploring the structural, mechanical, thermodynamic, and electronic properties of (Ni_0.66, Zn_0.33)3Sn₄ ternary intermetallic compounds by the first-principles study

Solvation of lithium ion in helium clusters: Structural properties and relative stabilities

Modification of geometrical and electronic structures of anionic and neutral silicon clusters by double-doped tantalum atoms

The geometry, electronic and magnetic properties of VLi _n (n = 2–13) clusters using the first-principles and PSO method

The magnetic binary lithium clusters W₂Li_n (n = 15‐19): A theoretical prediction of “di‐superatomic molecules”

Formation and superconducting properties of predicted ternary hydride ScYH₆ under pressures

Pressure-Stabilized New Phase of CaN₄