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framework-internalsdevelopment
relax
Prepare CP2K geometry-relaxation task inputs from a user-provided structure and optimization settings. Use when the user needs ion-only or cell-coupled optimization with explicit optimizer and convergence controls.
maintainer
jinzhezenggroup
์
๋ฐ์ดํธ๋จ 2026. 3. 24.
์คํ
32
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10
quick start
Installation and usage
Prepare CP2K geometry-relaxation task inputs from a user-provided structure and optimization settings. Use when the user needs ion-only or cell-coupled optimization with explicit optimizer and convergence controls.
์ค์น
$ install --globalskills.sh
์ฌ์ฉ๋ฒ
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skills use relax