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More extensive MP/WBM data analysis for site and SI #64
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and add cell delimiters to run as interactive notebook
generates element count periodic table heatmaps and target value histograms for MPtrj
add stress and stress_trace labels to plots.py quantity_labels
janosh
added
data
Data loading and processing
preprint
Concerning publication content
site
Website related
labels
Nov 24, 2023
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c4874f3 data/wbm/eda.py save MP/WBM element counts ptable heatmaps for paper SI
b0d74d2 json_to_extxyz.py add progress bar for MPtrj download
4d581d8 use new DATA_DIR in file paths where applicable
cb5320a update citation.cff author order and affiliations
9d6370f add MPtrj element counts as ptable heatmap to /data page
ee5d2c7 add data/mp/eda_mp_trj.py
d7ad893 data/wbm/eda.py add toggle normalize MP/WBM element count ratio
e6b9831 json_to_extxyz.py compress MPtrj JSON after figshare download
b68ad43 add /data/mptrj page showing histograms of MPtrj target properties