GitHub - knc6/JARVIS-FF: This project contains the data for evaluation of interatomic potentials/force-fields (used in Moecular-dynamics and Monte-carlo simulations). LAMMPS calculation were done using MPinterface code (https://github.com/JARVIS-Unifies/JARVIS-FF) and in.elastic script in LAMMPS/examples/ELASTIC folder (https://github.com/lammps/lammps/tree/master/examples/ELASTIC) on the structures downloaded from materials project (MP) using REST API (https://www.materialsproject.org/).Force-fields were downloaded from interatomic potential repository project(http://www.ctcms.nist.gov/potentials/) and LAMMPS (https://github.com/lammps/lammps/tree/master/potentials). The interactive plot was made with Bokeh (http://bokeh.pydata.org/en/0.10.0/docs/gallery/periodic.html). Please note that the starting lattice parameters were taken from density functional theory (DFT) and not from experiments. Generic minimization parameters were chosen for LAMMPS run rather than testing them for each individual case such as energy convergence criterion and so on. Hence, there are chances that the calculation gets trapped in a local energy minima. Please read carefully the assumptions taken during calculations in the in.elastic script and use the data at your own risk !