LAMMPS inputs and data files

PSP is a python toolkit for predicting atomic-level structural models for a range of polymer geometries.

LAMMPS input from lammpstutorials.github.io

Convert files from the ATB repository to LAMMPS format

Examples and utilities for molecular dynamics simulations

A LAMMPS template for the molecular dynamics simulation of nanometric cutting of 3C-SiC using a diamond tool with a zero rake angle and a clearance angle of 10°

Performed molecular dynamics simulation of Argon particles in FCC arrangement.

LAMMPS tutorials for both beginners and advanced users

LAMMPS input files for vapour-solvated polymer brush simulations

M.Tech Project QMEL LAB IIT Kharagpur

A LAMMPS template for the molecular dynamics simulation of nanometric cutting of 3C-SiC using a diamond tool with a negative rake angle of 25° and a clearance angle of 10°

A LAMMPS template for the molecular dynamics simulation of nanometric cutting of 3C-SiC using a diamond tool with a negative rake angle of 30° and a clearance angle of 10°

A LAMMPS template for the molecular dynamics simulation of nanometric cutting of 3C-SiC using a diamond tool with a negative rake angle of 15° and a clearance angle of 10°