jchxu's repositories
Bader_charges
Simple script that takes charges from a Bader analysis and converts them to effective charges based on the valence electrons in the pseudopotential.
Language:PythonGPL-3.0000
dft-book
A book on modeling materials using VASP, ase and vasp
Language:Python000
easytrader
提供券银河/华泰客户端/雪球的基金、股票自动程序化交易以及自动打新,支持跟踪 joinquant /ricequant 模拟交易 和 实盘雪球组合, 量化交易组件
fireworks-vasp
Vasp plugin for fireworks utilizing Fireworks, Custodian and Pymatgen for running High-throughput VASP calculations
GUI_Coal_Base
init
Language:Python000
py-findpeaks
Overview of the peaks dectection algorithms available in Python
Language:PythonMIT000
VASP-GPU-Benchmarking
A project to benchmark the performance of the GPU-enabled versions of VASP on the University of Bath's HPC cluster.
VASP_script
Useful scripts for VASP
VaspBandUnfolding
a python class for dealing with VASP WAVECAR.