This article introduces a suite of tutorials designed to make learning LAMMPS more accessible to new users.
- Tutorial 1: Lennard-Jones fluid
- Tutorial 2: Pulling on a carbon nanotube
- Tutorial 3: Polymer in water
- Tutorial 4: Nanosheared electrolyte
- Tutorial 5: Reactive silicon dioxide
- Tutorial 6: Water adsorption in silica
- Tutorial 7: Free energy calculation
- Tutorial 8: ?
All the files corresponding to the tutorials can be found in the files/ folder. The Python scripts used to generate the plots are also provided.
Access the pdf from this link, or clone this repository and compile the tex file yourself by typing in a terminal:
make
- Simon Gravelle, Univ. Grenoble Alpes, CNRS, LIPhy, 38000 Grenoble, France
- Jacob R. Gissinger, Stevens Institute of Technology, Hoboken, NJ 07030, USA
- Axel Kohlmeyer, Institute for Computational Molecular Science, Temple University, Philadelphia, PA 19122, USA
- Simon Gravelle acknowledges funding from the European Union's Horizon 2020 research and innovation programme under the Marie Skłodowska-Curie grant agreement No 101065060$.
- Axel Kohlmeyer acknowledges financial support by Sandia National Laboratories under POs 2149742 and 2407526.