Pinned Repositories
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
pySSpredict
pySSpredict demo on nanoHUB: https://nanohub.org/tools/pysspredict
RankingPhaseFields
VaspBandUnfolding
a python class for dealing with VASP WAVECAR.
Dongsheng-Wen's Repositories
Dongsheng-Wen/pySSpredict
pySSpredict demo on nanoHUB: https://nanohub.org/tools/pysspredict
Dongsheng-Wen/BGO-CE_Acquisition_Tools
Bayesian-Gaussian Cluster Expansion Acquisition Functions Tools
Dongsheng-Wen/ChemDASH
Chemically Directed Atom Swap Hopping -- Crystal structure prediction by swapping atoms in unfavourable chemical environments
Dongsheng-Wen/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.
Dongsheng-Wen/LovelyPlots
Matplotlib style sheets to nicely format figures for scientific papers, thesis and presentations while keeping them fully editable in Adobe Illustrator.
Dongsheng-Wen/MSE_Fundamentals
Materials Science and Engineering Fundamentals Class Slides
Dongsheng-Wen/p4vasp
p4vasp, the VASP Visualization Tool
Dongsheng-Wen/PhaseFieldRanking
Unsupervised ranking of the elemental combinations (phase fields) by similarity with the patterns learnt from ICSD
Dongsheng-Wen/RankingPhaseFields
Dongsheng-Wen/VaspBandUnfolding
a python class for dealing with VASP WAVECAR.
Dongsheng-Wen/vc-ChemDASH
Chemically Directed Atom Swap Hopping -- Crystal structure prediction by swapping atoms in unfavourable chemical environments with variable composition functionality