Tutorials

Important

Before working with the tutorial, the following steps need to have been performed:

• installation of the aiida-lammps plugin (see the instructions)

• configure the LAMMPS code (see the instructions)

Running your first minimization calculation.

Learn how to run a LAMMPS minimization with AiiDA, using the Python API.

30 min

Beginner

Molecular dynamics

Learn how to run a LAMMPS molecular dynamics calculation.

20 min

Beginner

Raw calculation

Learn how to run a raw LAMMPS calculation based on an input file.

20 min

Beginner