Software Packages

DFT

• VASP
• OpenMX
  • OpenMX viewer
• GPAW
• Quantum Espresso
  • turboMagnon
  • PHonon
  • EPW (electron-phonon physics from first principles)
• ABINIT

TDDFT

• ELK
• Octopus
• SALMON
• TDDFT within ABINIT
• TDDFT within GPAW

GW

• Berkeley GW
• YAMBO

DMFT

• TRIQS
• DFT+DMFT within ABINIT

Quantum Monte Carlo

• QMCPACK

Quantum chemistry

• Q-Chem

Molecular dynamics

• LAMMPS

Micromagnetics and Atomistic Spin Dynamics

• MuMax
• VAMPIRE
• UppASD

Quantum transport

• KWANT
• TKWANT