Dongsheng-Wen's repositories
pySSpredict
pySSpredict demo on nanoHUB: https://nanohub.org/tools/pysspredict
BGO-CE_Acquisition_Tools
Bayesian-Gaussian Cluster Expansion Acquisition Functions Tools
ChemDASH
Chemically Directed Atom Swap Hopping -- Crystal structure prediction by swapping atoms in unfavourable chemical environments
ICSDClient
A python library for accessing the ICSD API Client. Under no affiliation with Fitz-Karlsruhe, please see https://icsd.fiz-karlsruhe.de/index.xhtml for further details.
LovelyPlots
Matplotlib style sheets to nicely format figures for scientific papers, thesis and presentations while keeping them fully editable in Adobe Illustrator.
MSE_Fundamentals
Materials Science and Engineering Fundamentals Class Slides
p4vasp
p4vasp, the VASP Visualization Tool
PhaseFieldRanking
Unsupervised ranking of the elemental combinations (phase fields) by similarity with the patterns learnt from ICSD
VaspBandUnfolding
a python class for dealing with VASP WAVECAR.
vc-ChemDASH
Chemically Directed Atom Swap Hopping -- Crystal structure prediction by swapping atoms in unfavourable chemical environments with variable composition functionality