Maximally-localized Wannier functions team @ THEOS


Members

Nicola Marzari (EPFL)
Giovanni Pizzi (EPFL)
Junfeng Qiao (EPFL)

Former members

Marco Gibertini (now at University of Modena and Reggio Emilia)
Antimo Marrazzo (now at University of Trieste)

Research:

Maximally-localized Wannier functions (MLWFs): development and application of the concept of maximally-localized Wannier functions for extended systems, including the proof of exponential localization for Wannier functions in 3-dimensional insulators and automation efforts using AiiDA workflows for the automatic calculation of MLWFs.

Selected publications:

Methods

Applications