| name | electronic |
| description | Prepare CP2K electronic-analysis task inputs from prior converged context. Use when the user requests post-ground-state electronic analyses and needs prerequisite-aware setup. |
| compatibility | Requires prior converged CP2K context, suitable basis/potential files, and runnable CP2K environment. |
| license | GPL-3.0-only |
| catalog-hidden | true |
| metadata | {"author":"qqgu","version":"0.1.0","repository":"https://github.com/cp2k/cp2k"} |
CP2K Electronic Analysis (Subskill)
Scope
This skill prepares post-ground-state electronic-analysis tasks.
It should:
- verify prerequisite converged context
- prepare analysis-specific input controls
- report assumptions and unresolved choices
It should not submit or execute jobs.
Prerequisites
Require explicit prior converged context compatible with requested analysis.
If prerequisites are missing, stop and ask for them.
Must provide
- source context path
- analysis intent (for example DOS/PDOS/band-like workflow)
- mesh/path/resolution policy as applicable
Usually should be explicit
- projection settings
- broadening/plotting policy
- export format expectations
Expected output
- analysis-stage input updates
- prerequisite check summary
- settings summary and assumptions
- handoff note to
dpdisp-submit if execution is requested
