dpdata-driver

SKILLWorkflowcommunity
v0.0.0jinzhezenggroupLGPL-3.0Updated 1mo agoSource →

Use dpdata Python Driver plugins to label systems (energies/forces/virials) via System.predict(), list available drivers, and build Driver objects (ase/deepmd/gaussian/sqm/hybrid). Use when working with dpdata Python API (not CLI) and you need driver-based energy/force prediction, plugin registratio

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128Repo stars
1Clients
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1mo agoLast update
Skill
Authorjinzhezenggroup
Version0.0.0
LicenseLGPL-3.0
CategoryWorkflow
Formatsskill.md
PromptNot published
Compatibility
Claude✓ Supported
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ChatGPT—
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About

Use dpdata Python Driver plugins to label systems (energies/forces/virials) via System.predict(), list available drivers, and build Driver objects (ase/deepmd/gaussian/sqm/hybrid). Use when working with dpdata Python API (not CLI) and you need driver-based energy/force prediction, plugin registration keys, or examples of using dpdata with ASE calculators or DeePMD models.

Keywords
skillclaude

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