relax

Name: relax
Author: jinzhezenggroup

SKILLWorkflowCommunity

v0.0.0jinzhezenggroupLGPL-3.0Aktualisiert vor 7 TQuelle →

Prepare DFTB+ geometry-relaxation task inputs from a user-provided structure and optimization settings. Use when the user needs ion-only or cell-coupled structural optimization.

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128Repo-Sterne

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vor 7 TLetzte Aktualisierung

Skill

Autorjinzhezenggroup

Version0.0.0

LizenzLGPL-3.0

KategorieWorkflow

Formateskill.md

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Prepare DFTB+ geometry-relaxation task inputs from a user-provided structure and optimization settings. Use when the user needs ion-only or cell-coupled structural optimization.

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