phonon topic
phonon
Phonon is a responsive front-end framework with a focus on simplicity and flexibility
GPUMD
Graphics Processing Units Molecular Dynamics
alamode
Ab initio simulator for thermal transport and lattice anharmonicity
DynaPhoPy
Phonon anharmonicity analysis from molecular dynamics
phonolammps
LAMMPS interface for phonon calculations using phonopy
qha
A Python package for calculating thermodynamic properties under quasi-harmonic approximation, using data from ab-initio calculations
PHNEGF
Python scripts to investigate the phonon transport for perfect crystal on the basis of NEGF theory
cij
Semiemperical quasiharmonic thermal elasticity