Efficient calculation of carrier scattering rates from first principles

oleh: Alex M. Ganose, Junsoo Park, Alireza Faghaninia, Rachel Woods-Robinson, Kristin A. Persson, Anubhav Jain

Format: Article
Diterbitkan: Nature Portfolio 2021-04-01

Deskripsi

It is difficult to compute the transport properties of a broad array of complex materials both accurately and inexpensively. Here, the authors develop a computationally efficient method for calculating carrier scattering rates of semiconductors, with good accuracy but low cost.