Electronic Properties of Si and C Substitutional Defects and Porosity in C-Rich and Si-Rich Hydrogenated Roundish SiC Quantum Dots: An Ab-Initio Study.

First principles study of hydrogen storage on B-doped SiC monolayers through light transition metal atoms

A comparative DFT study of CO and NO capture by copper- and titanium-functionalized SiC and GeC monolayers