Managing workflows and projects

NOMAD Tutorial Workflow provides a stand-alone tutorial on workflow and project management with NOMAD. It utilizes the nomad-utility-workflows Python module to lower the entry barrier for advanced NOMAD usage.

What you will learn

• Organize and manage complex research workflows using NOMAD
• Integrate diverse data sources into a single, reproducible project
• Track data provenance and metadata
• Interface with the NOMAD repository programmatically for automation and high-throughput use

Recommended tools and background (for efficiency and automation)

• Terminal environment: Install the workflow utility module via Bash (Linux/macOS) or PowerShell (Windows)

• Basic Python knowledge: Utilize workflow utility tools using provided Jupyter notebooks