Evolution of physicochemical properties as function of size and design principles of transition-metal dichalcogenide nanoflakes: insights from Ab initio investigations - Caturello, Naidel Antonio Moreira dos Santos; Besse, Rafael; Silva, Augusto Cesar Huppes da; Guedes Sobrinho, Diego; Lima, Matheus P.; Silva, Juarez Lopes Ferreira da (Materials Research Society Fall Meeting and Exhibit, 2019)