Automatic Generation of FAIR Metadata for Quantum ESPRESSO DFT Calculations: MATSCI-NASU DFT Extractor
Type: Manual
Topics
- FAIR data
- EOSC
- Metadata
- DMP
- Quantum ESPRESSO
- Materials workflows
- Pilot chains
Audience
- Researchers
- Data stewards
Related RI objects
Services
- DFT workflow support for materials research
- Computational modelling of metallic systems
- FAIR packaging of computational materials datasets
- Metadata and DOI support for materials data
- README and DMP support for RI users
- Support for pilot use case development
Resources
- Quantum ESPRESSO
- Metallic systems modelling workflows
- FAIR checklist for materials datasets
- Computational materials dataset profile
- README template for computational materials datasets
- Metadata checklist for materials datasets