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ComCat Lab Welcome Guide
Creating a CCDB Account (WIP)
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ComCat Lab Welcome Guide
GitHub
Overview
Overview
Home
Quickstart
Computational Catalysis in a Nutshell
Software Pages
Samples
Samples
Python Scripts
Bash Profile
Slurm Submission Files (WIP)
Tutorials
Tutorials
Intro
Creating a CCDB Account (WIP)
Transferring Data to a Remote Cluster (WIP)
✨ Make your own Quantum ESPRESSO compilation ✨
How to Optimize Resource Requests (WIP)
Calculate IR Intensities with VASP (WIP)
Additional Resources
Additional Resources
Troubleshooting
Snippets
Useful Links
Development Guide
Development Guide
Setting Up
Contributing
Building the Documentation
Setting Up the Tests
Code of Conduct
Creating a CCDB Account (WIP)
You should receive an email invitation.