YunxingZuo's repositories
materialsproject
This code helps to grab the like-POSCAR files of different materials from materials project.
cmake_example
Example pybind11 module built with a CMake-based build system
gp_extras
Additional kernels that can be used with scikit-learn's Gaussian Process module
hello-world
This is my first project named hello-world.
json-tutorial
从零开始的 JSON 库教程
lammps
Public development project of the LAMMPS MD software package
projects
Projects. And then some.
pymatgen
Python Materials Genomics (pymatgen) is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It is currently the core analysis code powering the Materials Project.
randSpg
C++ functions for generating random crystals that have certain spacegroups.
veidt
Veidt is a deep learning library for materials science.