Ceder Group

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30 repositories

smol
Public
Statistical Mechanics on Lattices
monte-carlo statistical-mechanics ising-model materials-science lattice-gas cluster-expansion
Python
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Other
•15•66•18•1•Updated Dec 18, 2024Dec 18, 2024
WFacer
Public
Modulated automation of cluster expansion based on atomate2 and Jobflow
statistical-mechanics cluster-expansion atomistic-modelling lattice-thermodynamics
Python
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Other
•1•11•2•13•Updated Dec 14, 2024Dec 14, 2024
chgnet
Public
Pretrained universal neural network potential for charge-informed atomistic modeling https://chgnet.lbl.gov
machine-learning atomistic-simulations force-fields graph-neural-networks charge-transport charge-distribution computational-materials-science
Python
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Other
•67•259•3•0•Updated Nov 16, 2024Nov 16, 2024
alab_control
Public
Python
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MIT License
•2•4•56•0•Updated Nov 16, 2024Nov 16, 2024
sparse-lm
Public
Sparse Linear Regression Models
Python
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Other
•7•15•2•3•Updated Nov 4, 2024Nov 4, 2024
alabos
Public
AlabOS: Managing the workflows in the Autonomous lab
Python
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MIT License
•8•36•21•0•Updated Oct 22, 2024Oct 22, 2024
synthesis-action-retriever
Public
Annotated dataset and scripts for automatic retrieval of materials synthesis actions.
Python
•2•4•1•0•Updated Mar 18, 2024Mar 18, 2024
MatEntityRecognition
Public
Extract materials from paragraphs and recognize the targets and precursors
Python
•3•5•0•2•Updated Mar 13, 2024Mar 13, 2024
MaterialAmountExtractor
Public
Python
•0•0•0•0•Updated Mar 13, 2024Mar 13, 2024
text2chem
Public
RegEx-based text parser that converts chemical terms and material entities into chemical datastructure.
natural-language-processing text-mining named-entity-recognition material-science
Python
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MIT License
•5•3•1•0•Updated Feb 4, 2024Feb 4, 2024
SynthesisSimilarity
Public
Python
•4•26•0•0•Updated Nov 16, 2023Nov 16, 2023
ValenceSolver
Public
Python
•0•0•0•0•Updated Nov 13, 2023Nov 13, 2023
text-mined-synthesis_public
Public
Codes for text-mined solid-state reactions dataset
natural-language-processing materials-science text-mining dataset inorganic-materials-synthesis solid-state-reactions
Python
•19•68•2•0•Updated Oct 7, 2023Oct 7, 2023
.github
Public
shared file and templates repo
0•0•0•0•Updated Sep 27, 2023Sep 27, 2023
alab_experiment_helper
Public
Python
•1•0•0•0•Updated Dec 13, 2022Dec 13, 2022
s4
Public
Solid-state synthesis science analyzer. Thermo, features, ML, and more.
machine-learning thermodynamics materials-science materials-informatics feature-importance solid-state-synthesis
Jupyter Notebook
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MIT License
•7•24•0•0•Updated Sep 1, 2022Sep 1, 2022
text-mined-solution-synthesis_public
Public
Jupyter Notebook
•3•16•1•0•Updated May 25, 2022May 25, 2022
synthesis-paragraph-classifier
Public
Codes and models for "Semi-supervised machine-learning classification of materials synthesis procedures". (https://doi.org/10.1038/s41524-019-0204-1)
topic-modeling materials-science journal-article classification-model
Python
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MIT License
•3•9•0•0•Updated Apr 24, 2022Apr 24, 2022
SynCheck
Public
SynCheck is a web interface for the Text Mining Pipeline that processes synthesis text, extracts information about targets, precursors and synthesis operations, and constructs synthesis graph.
nlp natural-language-processing material-design materials-science materials-informatics material-synthesis
Python
•1•0•0•0•Updated Mar 5, 2022Mar 5, 2022
MatBERT_NER
Public
General training framework for NER models on MatBERT
Python
•7•9•2•0•Updated Feb 13, 2022Feb 13, 2022
TEMExtraction-webapp
Public
Jupyter Notebook
•0•2•0•0•Updated Dec 23, 2021Dec 23, 2021
TEMExtraction
Public
Jupyter Notebook
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MIT License
•1•6•0•0•Updated Dec 23, 2021Dec 23, 2021
MaterialParser
Public
Utility to compile string of chemical terms into data structure with chemical formula and composition
python natural-language-processing text-mining materials-science chemical-compounds composition material-parser chemical-terms
Python
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MIT License
•7•13•4•1•Updated Sep 17, 2021Sep 17, 2021
text-mined-aunp-synthesis_public
Public
Jupyter Notebook
•1•6•0•0•Updated Sep 15, 2021Sep 15, 2021
MatBERT-synthesis-classifier
Public
A synthesis paragraph classifier built by fine-tuning MatBERT
nlp classifier materials-science bert-model
Python
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MIT License
•3•5•0•0•Updated May 13, 2021May 13, 2021
ReactionCompleter
Public
Heuristics to complete a chemical reaction
Python
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MIT License
•2•2•0•0•Updated Mar 25, 2021Mar 25, 2021
LimeSoup
Public
LimeSoup is a package to parse HTML or XML papers from different publishers.
python nlp html parser xml journal-article
Python
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MIT License
•7•19•2•0•Updated Jan 4, 2021Jan 4, 2021
TextCleanUp
Public
Clean-up tools for text and materials names and everything else
Python
•1•2•2•0•Updated Feb 27, 2020Feb 27, 2020
Borges
Public
Web Scarping Engines
Python
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MIT License
•4•7•0•0•Updated Jan 7, 2020Jan 7, 2020
MultiFil
Public
High Throughput PathFinder and ApproxNEB repo
Python
•0•2•0•0•Updated Dec 11, 2017Dec 11, 2017