Density Functional Theory (DFT)
Qbox
(Gordon Bell Prize awarded to Francois Gygi for the Qbox code)
Quantum ESPRESSO
MGmol
MondoSCF
Quantum Monte Carlo (QMC)
CASINO
QMCPACK
Dynamic Mean Field Theory (DMFT)
FPLO
and aeDMFT
Maximally-Localised Wannier functions(MLWFs)
Wannier90