Big Data methods to tune perovskites to target properties: alloys, defects and doping
Machine learning methods applied to the study of interfaces between semiconductors
Machine learned potentials for molecular dynamics simulations of halide perovskites
Electronic and structural properties and phase transition of PbZr (1-0.5) Ti(0.5)O...
Two-Dimensional Nano-Heteroestructures: DFT Simulations and Machine Learning of In...
Theoretical investigation of chiral molecules in the physicochemical properties of...