lammps topic

Tool to build force field input files for molecular simulation

paduagroup

Phonon anharmonicity analysis from molecular dynamics

abelcarreras

Software Suite for Advanced General Ensemble Simulations

SSAGESproject

pwtools is a Python package for pre- and postprocessing of atomistic calculations, mostly targeted to Quantum Espresso, CPMD, CP2K and LAMMPS. It is almost, but not quite, entirely unlike ASE, with so...

elcorto

LAMMPS interface for phonon calculations using phonopy

abelcarreras

custom LAMMPS fix used for Brownian Dynamics Simulation (Overdamped Langevin)

anyuzx

VSCODE extension for language support of LAMMPS scripts

ThFriedrich

Tool to read a logfile produced by LAMMPS into a simple python data structure with a get()-function providing the log data.

henriasv

Scripts, tools, documentation and supporting libraries and files for building pre-compiled LAMMPS packages

lammps

pyiron_atomistics - an integrated development environment (IDE) for atomistic simulation in computational materials science.

pyiron