dft-cp2k
OfficialRoute CP2K requests to subskills efficiently.
Education & Research#automation#workflow#routing#orchestration#subskill#computational-chemistry#cp2k
Authorjinzhezenggroup
Version1.0.0
Installs0
System Documentation
What problem does it solve?
Route CP2K requests to task-specific subskills based on user intent and ensure consistent handoff to submission components.
Core Features & Use Cases
- Routing: classifies requests into one of the CP2K task types (static, relax, md, electronic) and validates prerequisites.
- Dispatch: selects the appropriate subskill path and prepares a handoff-ready task layout.
- Guardrails: exposes assumptions and unresolved choices to the user and avoids executing jobs directly.
Quick Start
Direct the agent to route a CP2K workload to the appropriate subskill path (static, relax, md, or electronic) after ensuring prerequisite context.
Dependency Matrix
Required Modules
None requiredComponents
references
💻 Claude Code Installation
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Please help me install this Skill: Name: dft-cp2k Download link: https://github.com/jinzhezenggroup/computational-chemistry-agent-skills/archive/main.zip#dft-cp2k Please download this .zip file, extract it, and install it in the .claude/skills/ directory.
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