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Density Functional Theory simulation tools. Use for calculating electronic structure, band gaps, formation energies, and quantum mechanical properties of battery materials.

Install Skill

1Download skill
2Enable skills in Claude

Open claude.ai/settings/capabilities and find the "Skills" section

3Upload to Claude

Click "Upload skill" and select the downloaded ZIP file

Note: Please verify skill by going through its instructions before using it.

SKILL.md

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