UCL-ARC / UCL-ARC/rcps-buildscripts
Install Request: GPAW
Open
Nobody has claimed this yet.
App install
Young
- Dominant language
- Shell
- Stars
- 42
- Forks
- 26
- PR merge metrics
- No merged PRs in 30d
Description
GPAW is a density-functional theory (DFT) Python code based on the projector-augmented wave (PAW) method and the atomic simulation environment (ASE).
Application: GPAW version 24.6.0
Link: https://gitlab.com/gpaw/gpaw
Cluster: Young
Contributor guide
No contributing guide indexed for this repository
First steps
- Read the whole issue, then the project's contributing guide.
- Comment on the issue to say you are picking it up — it saves two people doing the same work.
- Fork the repository and make your change on a branch.
- Open a pull request that references the issue number.
Research direction
Start by reviewing the repository's existing package build scripts and the GPAW 24.6.0 release information linked in the issue. Confirm the requirements for the Young cluster and determine what verification is expected; done means GPAW 24.6.0 is successfully installed and usable there.
Written by the indexing model from the issue text.
Assessment
- Tech stack
- python
- Domain
- build-system, hpc
- Issue type
- Feature
- Difficulty
- 4/5
- Estimated time
- 3-5 days
- Activity status
- Stale
- Clarity
- Needs clarification
- Newbie friendliness
- 25/100