Open-source makes the world a better place.
Share your knowledge and expertise.
This is a complete list of my Github projects.
Open Source Projects
I have 12 projects on Github
ML-IAPs_iron
Potential file and training scripts of multiple machine learning interatomic potentials.
Potential_benchmark_iron
Test interatomic potential by Benchmarking with several physical properties using LAMMPS
Fe-GAP22-AL
Active learning script to enable fracture prediction of GAP
MoltenSaltCalc
Molten salt simulation package
Interatomic-potential-Test
Basic properties prediction workflow: E-V curve, elastic constants, vacancy formation energy, surface energy and stacking fault energy.
pyLabDD
Python Laboratory for Dislocation Dynamics
leiapple.github.io
Personal website
Fe-GAP22
Fe-GAP22 DFT database, potential file and training commands.
PySim-MoltenSaltCorrosion
matscipy
Materials science with Python at the atomic-scale
comments
store the comments from the blog
ACE-BCC-TMs
ACE potentials for bcc metals: V, Nb, Ta, Mo, and W. Python scripts for simulating screw dislocations.