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
Performed molecular dynamics simulation of Argon particles in FCC arrangement.
LAMMPS tutorials for both beginners and advanced users
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°
LAMMPS input files for vapour-solvated polymer brush simulations
M.Tech Project QMEL LAB IIT Kharagpur
Thermal properties of liquid entrapped between hybrid wettability surface, Computational Materials Science, Volume 244, 2024, 113232, ISSN 0927-0256,
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°
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 25° and a clearance angle of 10°
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