1 code implementation • 31 Jan 2020 • Vijay Singh, Uthpala Herath, Benny Wah, Xingyu Liao, Aldo H. Romero, Hyowon Park
The existence of this library allows developers of other DFT codes to interface with our package and achieve the charge-self-consistency within DFT+DMFT loops.
Strongly Correlated Electrons
1 code implementation • 26 Jun 2019 • Uthpala Herath, Pedram Tavadze, Xu He, Eric Bousquet, Sobhit Singh, Francisco Muñoz, Aldo H. Romero
A file with a specific property evaluated for each $k$-point in a $k-$mesh and for each band can be used to project other properties such as electron-phonon mean path, Fermi velocity, electron effective mass, etc.
Materials Science