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GitHub topics: lammps-python-interface

pyiron/pylammpsmpi

Parallel Lammps Python interface - control a mpi4py parallel LAMMPS instance from a serial python process or a Jupyter notebook

Language: Python - Size: 804 KB - Last synced at: 1 day ago - Pushed at: 1 day ago - Stars: 33 - Forks: 5

ovitrac/Pizza3

Toolkit for multiscale modeling with LAMMPS in Python 3.x. It integrates with LAMMPS-GUI and leverages Large Language Models for rapid prototyping.

Language: HTML - Size: 432 MB - Last synced at: 16 days ago - Pushed at: about 2 months ago - Stars: 4 - Forks: 3

abelcarreras/phonolammps

LAMMPS interface for phonon calculations using phonopy

Language: Python - Size: 2.27 MB - Last synced at: about 1 month ago - Pushed at: 9 months ago - Stars: 85 - Forks: 26

kevinshen56714/emc-pypi

Python interface for Enhanced Monte Carlo (EMC)

Language: Perl - Size: 35.5 MB - Last synced at: 17 days ago - Pushed at: about 2 months ago - Stars: 19 - Forks: 0

evenmn/lammps-simulator

Python package for launching LAMMPS simulations

Language: Python - Size: 2.89 MB - Last synced at: 6 days ago - Pushed at: almost 2 years ago - Stars: 7 - Forks: 4

SSAGESLabs/lammps-dlext

Wrapper for LAMMPS simulation data into DLPack data structures

Language: C++ - Size: 133 KB - Last synced at: almost 2 years ago - Pushed at: almost 2 years ago - Stars: 0 - Forks: 1