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Pull requests: ddmms/ml-peg
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Cu h2o rdf
new benchmark
Proposals and suggestions for new benchmarks
#470
opened Apr 15, 2026 by
IsaacParker30
•
Draft
5 tasks done
⚡ Bolt: Add lru_cache to load_framework_registry
#469
opened Apr 15, 2026 by
alinelena
Collaborator
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⚡ Bolt: Cache framework registry loading
#468
opened Apr 14, 2026 by
alinelena
Collaborator
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⚡ Bolt: Prevent repetitive models.yml parsing via lru_cache in get_models
#463
opened Apr 13, 2026 by
alinelena
Collaborator
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⚡ Bolt: Cache yaml loading in get_models.py
#462
opened Apr 12, 2026 by
alinelena
Collaborator
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Add CMRAds200 adsorption energies benchmarks
new benchmark
Proposals and suggestions for new benchmarks
#461
opened Apr 12, 2026 by
benshi97
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5 tasks done
⚡ Bolt: Cache
models.yml loading for performance
#460
opened Apr 11, 2026 by
alinelena
Collaborator
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Add WiSE electrolyte benchmark (density, X-ray S(q), Li-O RDF)
new benchmark
Proposals and suggestions for new benchmarks
#445
opened Apr 3, 2026 by
LucaBrugnoli
•
Draft
5 tasks done
Split vacancies benchmark
new benchmark
Proposals and suggestions for new benchmarks
#437
opened Mar 23, 2026 by
ThomasWarford
Contributor
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1 of 5 tasks
Add HPHT_CH4_H2O free energy profile of proton hopping benchmark
new benchmark
Proposals and suggestions for new benchmarks
#436
opened Mar 23, 2026 by
ThomasThevenet
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4 of 5 tasks
Feat/add folmsbee conformer benchmark
new benchmark
Proposals and suggestions for new benchmarks
#429
opened Mar 16, 2026 by
lwehrhan
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4 of 5 tasks
Bond dissociation energy benchmark
new benchmark
Proposals and suggestions for new benchmarks
#426
opened Mar 12, 2026 by
gelzinyte
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5 tasks done
Volume scans going to very high densities
new benchmark
Proposals and suggestions for new benchmarks
#421
opened Mar 10, 2026 by
JPDarby
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5 tasks done
download button for csv, png, svg - attempt 2
enhancement
New feature or request
#420
opened Mar 10, 2026 by
joehart2001
Collaborator
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1 task done
Add superacid HF/SbF5 density benchmark Ref #379
new benchmark
Proposals and suggestions for new benchmarks
#410
opened Mar 5, 2026 by
mattiaperr
•
Draft
3 of 5 tasks
Adding cleavage benchmarks
new benchmark
Proposals and suggestions for new benchmarks
#404
opened Mar 4, 2026 by
vue1999
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5 tasks done
Plutonium Dioxide benchmark
new benchmark
Proposals and suggestions for new benchmarks
#396
opened Mar 1, 2026 by
williamdavie
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5 tasks done
Setup solid-state electrolytes benchmark
new benchmark
Proposals and suggestions for new benchmarks
#394
opened Feb 26, 2026 by
ThiagoReschutzegger
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5 tasks done
Metal surface reconstuctions benchmark
new benchmark
Proposals and suggestions for new benchmarks
#392
opened Feb 25, 2026 by
Felixrccs
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5 tasks done
Add Ti64 and diamond phonon benchmarks
new benchmark
Proposals and suggestions for new benchmarks
#391
opened Feb 24, 2026 by
7radians
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6 tasks done
New benchmark: Elemental Transition Metals Vacancy Formation Energies
new benchmark
Proposals and suggestions for new benchmarks
#390
opened Feb 23, 2026 by
alxdr-peuch
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5 tasks done
Element filtering
enhancement
New feature or request
#368
opened Feb 16, 2026 by
joehart2001
Collaborator
•
Draft
1 task done
Aqueous Iron Chloride Oxidation States
lr
new benchmark
Proposals and suggestions for new benchmarks
#360
opened Feb 11, 2026 by
PKourtis
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4 of 5 tasks
Low dimensional benchmark
new benchmark
Proposals and suggestions for new benchmarks
#355
opened Feb 9, 2026 by
JonathanSchmidt1
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5 tasks done
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