mxl-postprocess

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This skill should be used when users need to extract, export, and plot MaxwellLink outputs from molecules and EM solvers (e.g., `additional_data_history`, cavity histories, spectra helpers).

TaoELi By TaoELi schedule Updated 2/7/2026
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name: mxl-postprocess description: This skill should be used when users need to extract, export, and plot MaxwellLink outputs from molecules and EM solvers (e.g., additional_data_history, cavity histories, spectra helpers).

Post-processing and export

Collect molecular diagnostics

  • Read per-molecule diagnostics from molecule.additional_data_history (list of dicts).
  • Convert to arrays by extracting keys (time_au, mux_au, Pe, energy_au, ...).

Collect solver histories (when enabled)

  • For SingleModeSimulation(record_history=True), use sim.time_history, qc_history, pc_history, and molecule_response_history.
  • For LaserDrivenSimulation(record_history=True), use sim.time_history, drive_history, and molecule_response_history.

Export

  • Write CSV/NPZ from the collected arrays for reproducibility and downstream plotting.
  • Keep the export code inside the project folder so it travels with inputs.

References

  • Snippets: skills/mxl-postprocess/references/postprocessing.md
  • Tools: src/maxwelllink/tools/ (pulse helpers and spectra utilities)
Install via CLI
npx skills add https://github.com/TaoELi/MaxwellLink --skill mxl-postprocess
Repository Details
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