期刊： COMPUTATIONAL CONDENSED MATTER, 2020; 25 ()
We propose a superlattice structure by repeating TiO and perovskite ATiO(3) layers and use first-principles calculations to investigate its physical p......
期刊： COMPUTATIONAL CONDENSED MATTER, 2020; 25 ()
Using our recently developed theoretical inverse-design method (PooMa) a new series of branched oligothiophene molecules for photovoltaic donors are d......
