In this study, a thin film of Si-Ge-Sn alloy with a gradient composition distribution was synthesized using combinatorial magnetron sputtering. This thin-film ternary material library was electrochemi
Computational high-throughput screening using molecular simulations is a powerful tool for identifying top-performing metal–organic frameworks (MOFs) for gas storage and separation applications. Accur
We present the ElasTool package, an automated toolkit for calculating the second-order elastic constants (SOECs) of any two- (2D) and three-dimensional (3D) crystal systems. ElasTool uses three kinds
