Energy response#523

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viktorsvahn wants to merge 22 commits into

viktorsvahn:energy_response

Commits on Mar 18, 2026

Commits on Mar 19, 2026

small changes
viktorsvahn
committed

Commits on Mar 23, 2026

Commits on Apr 24, 2026

Electric field response, rather than total energy, is now measured.
viktorsvahn
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This will now cover energy response over different organic molecule datasets.
viktorsvahn
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Updated energy response analysis. Not finihsed yet.
viktorsvahn
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Commits on Apr 27, 2026

Commits on Apr 28, 2026

Commits on May 1, 2026

Commits on May 2, 2026

Commits on Jun 23, 2026

Fixed errenous calculations, missing plots and 3D structures within the app
viktorsvahn
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Commits on Jul 2, 2026

models.yml is now the same as in the original repo.
viktorsvahn
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