Beginner LAMMPS tutorials in Jupyter notebooks — lattice energy, tension and compression, grain boundaries, fracture, and polymer chains
LAMMPS tutorials for both beginners and advanced users
LAMMPS input from lammpstutorials.github.io
Required LAMMPS and MATLAB files for several molecular dynamics simulations.
Provides some useful information and the LAMMPS input files to model a polymer-metal interface.
LAMMPS scripts to simulate uniaxial tensile test of a graphene Sample
Contains the MD model used in the article Dewapriya and Miller, J. Appl. Mech. 88(10): 101005 (2021).
Contains the model used for impact simulations in the article Dewapriya and Miller, Comput. Mater. Sci., Vol. 195, 110504 (2021).
LAMMPS files to simulate a small polyurethane chain
Contains LAMMPS and VASP models used to compute nonbonded interaction parameters in Dewapriya and Miller, Extreme Mechanics Letters, vol. 44, 101238 (2021).
LAMMPS tutorials for both beginners and advanced users
LAMMPS tutorials and exercises.
Modern LAMMPS + Python replication of Rahman's foundational 1964 liquid-argon molecular dynamics, with a from-trajectory analysis package (g(r), MSD/diffusion, VACF, Van Hove).
A repository for the LAMMPS tutorials avatars and logos
A LAMMPS script that generates a periodic regular polymer network.
M.Tech Project QMEL LAB IIT Kharagpur
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