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stfc / janus-core Public

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Add NEB [WIP]#393

Draft

ElliottKasoar wants to merge 3 commits intostfc:mainstfc/janus-core:mainfrom ElliottKasoar:add-nebElliottKasoar/janus-core:add-nebCopy head branch name to clipboard

+568-23

Conversation Commits3 (3)Checks Files changed

Commits

Commits on Jan 31, 2025

Refactor setting minimize_kwargs
ElliottKasoar
committed
Add NEB calculation
ElliottKasoar
committed
Add interpolation options
ElliottKasoar
committed

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