Code Name

Field

Owner

Access

OS

Source?

Github?

Quantum Espresso

Atomistics / DFT

 

 

Linux

 

 

VASP

Atomistics / DFT

PSU

NSE (Ballinger)

Linux

X

 

GULP

Molecular Dynamics

 

 

 

 

 

LAMMPS

Molecular Dynamics

Sandia

Sandia

All

 

X

Moldy

Molecular Dynamics