python-ase
Pass
Audited by Gen Agent Trust Hub on Jul 2, 2026
Risk Level: SAFEEXTERNAL_DOWNLOADSCOMMAND_EXECUTION
Full Analysis
- [SAFE]: The skill provides legitimate technical reference material and code examples for the Atomic Simulation Environment (ASE) Python library, which is a standard tool used in scientific research.
- [EXTERNAL_DOWNLOADS]: The documentation suggests installing well-known scientific packages (ase, gpaw) from official registries, which is standard practice for the computational chemistry domain.
- [COMMAND_EXECUTION]: The skill includes scripts for scientific simulations that perform expected file operations (saving trajectories and plots) and execute specialized calculators, all of which are consistent with the stated purpose and use case.
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