Agent-Skills.md

Agent Skills: Structure Figures

Generate or update schematic structure figures (SVGs) used in CLEED docs and example inputs.

UncategorizedID: Liam-Deacon/CLEED/structure-figures

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Liam-Deacon/CLEED
Liam-DeaconLicense: NOASSERTION
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skills/structure-figures/SKILL.md

Skill Metadata

Name
structure-figures
Description
Generate or update schematic structure figures (SVGs) used in CLEED docs and example inputs.

Structure Figures

Use this skill when adding or updating schematic structure figures for the CLEED examples and docs (e.g., Ni111 unit cell, Ni(111) slab, 2x2 O overlayer).

Quick start

Generate or refresh the SVGs in doc/_static/figures:

python3 skills/structure-figures/scripts/generate_structure_figures.py \
  --out-dir doc/_static/figures

Notes

  • The script is the source of truth for these assets:
    • doc/_static/figures/ni111_unit_cell.svg
    • doc/_static/figures/ni111_surface_slab.svg
    • doc/_static/figures/ni111_2x2o_overlayer.svg
  • The figures are referenced from doc/file_formats/bul.rst and doc/file_formats/inp.rst; update captions or cross-references there if the examples change.
  • If PNGs are required for a downstream target, convert from SVG using a local tool (e.g., rsvg-convert or inkscape) and commit only the resulting static asset files.