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LAMMPS
The LAMMPS software simulates classical molecular dynamics, with a focus on materials modeling.

About LAMMPS
LAMMPS is a classical molecular dynamics code with a focus on materials modeling. Its name stands for Large-scale Atomic/Molecular Massively Parallel Simulator. The homepage describes it as software that is downloaded and run, either on a single processor or in parallel, rather than as a hosted web application. It includes potentials for solid-state materials such as metals and semiconductors, and for soft matter such as biomolecules and polymers. It can also model coarse-grained or mesoscopic systems, and the homepage notes it can be used as a parallel particle simulator at the atomic, meso, or continuum scale.
The homepage states that LAMMPS is distributed as open source software under the GPLv2 and that all development takes place on GitHub. Pricing is not stated on the homepage.
Key features
- Classical molecular dynamics simulation with a focus on materials modeling
- Potentials for solid-state materials such as metals and semiconductors
- Potentials for soft matter including biomolecules and polymers
- Coarse-grained and mesoscopic system modeling
- Parallel runs using message passing and spatial decomposition of the domain
- Accelerated versions of many models for CPUs and GPUs
- Distributed as open source software under the GPLv2, according to the homepage
- Can run on single processors or in parallel using message-passing techniques
- Designed to be easy to modify or extend with new functionality
LAMMPS at a glance
- Website
- lammps.org
- Type
- Website
- Pricing
- Not confirmed. Check the site
- Platforms
- Web
- Open source
- Not stated
- Language
- English
- Last checked
- Oct 6, 2026 · Online when checked
- Listed
- Oct 5, 2026
LAMMPS alternatives
Tools and sites you could use instead, ranked by how closely they match.
MolView lets users search chemical compounds and access molecular viewing and chemistry information.
OpenFOAM is open-source computational fluid dynamics software, with downloads and documentation for simulation workflows.
OpenFOAM publishes news and access to its computational fluid dynamics software, including release and patch notes.
CFDTool provides a computational fluid dynamics toolbox for running simulations.
Wokwi simulates embedded systems and IoT projects, including Arduino, ESP32, and STM32 boards.
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LAMMPS FAQ
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