Add electric field calculation library - #78

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samwaseda wants to merge 38 commits into

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Commits on May 5, 2026

Add original version of field calculation
samwaseda
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df014fb
ChatGPT version of field calculation
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7a42ba2
Add unit information to type hints and remove unit conversion
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1afc883

Commits on May 6, 2026

Conversion correction
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e6aa2fc
improve fix algorithm and use ase converter
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19d2af1
Merge branch 'numpy' into libs
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ruff-sort
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black
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1e2129b
Merge branch 'numpy' into libs
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dc17d30
Merge remote-tracking branch 'origin' into libs
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3ae166d
Merge branch 'false' into libs
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803adea
Merge branch 'false' into libs
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black
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Merge branch 'false' into libs
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cc3b2ec
Merge remote-tracking branch 'origin' into libs
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587e1a8
Current state
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dc19c29
Merge branch 'transpath' into libs
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f307986
Correction for TS
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9ae15fc
correction for fixed_layers
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2087af0
Apply e_energy and i_energy
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bd89c61
Insert correct position for z
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02c91a4
Add unit conversion
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ee62621
Correct k point and structure
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128b7ba
Refactor functions
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3862d4c
black
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ruff import
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mypy
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0ac9c93
Add unit tests for sphinx_parser/lib/field.py

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samwaseda
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85f2c79
remove _version.py
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248d5ce
Improve PES_xy tests to validate constraint types in sphinx structure output

Copilot
and
samwaseda
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cf60425
black
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3895750
ruff
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ruff sort
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a66726c
ruff sort
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c37653f

Commits on May 9, 2026

Merge remote-tracking branch 'origin' into libs
samwaseda
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c1658e9

Commits on May 10, 2026

Remove obvious comments
samwaseda
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f0038a4
Add blockCCG
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f8cb6d7

Commits on Jun 30, 2026

Merge remote-tracking branch 'origin' into libs
samwaseda
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2ca5ddc