cyberneticlibrary
← library

Prepare electronic analysis workflows

electronicskillsetup L1★67
jinzhezenggroup/computational-chemistry-agent-skills ↗
What it does

Prepare CP2K electronic-analysis task inputs from prior

Best for

When 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

Requires
  • · HTTP/REST API
Preconditions

Require explicit prior converged context compatible with requested analysis.

Failure modes

Prerequisite not met or invalid input parameters

Trust signals
  • · Open-source repo: jinzhezenggroup/computational-chemistry-agent-skills
  • · License: MIT