Repositories list

• PSyclone

  Public
  PSyclone is a source-to-source Fortran compiler designed to programmatically optimise, parallelise and instrument HPC applications via user-provided transformation scripts.

  pythoncompilerfortran+ 7optimizationparallel-computinghigh-performance-computingfinite-elementsfinite-differencefinite-volumehacktoberfest

  Python

  •

  BSD 3-Clause "New" or "Revised" License

  •31•123•713•33•Updated Nov 25, 2025Nov 25, 2025

• SCD-OpenStack-Utils

  Public
  A catch-all repo for utilities used by the STFC Openstack Cloud

  Python

  •

  Apache License 2.0

  •14•1•0•3•Updated Nov 25, 2025Nov 25, 2025

• cloud-deployed-apps

  Public
  A collection of charts and values deployed on STFC Cloud Clusters

  Shell

  •

  GNU General Public License v3.0

  •6•1•0•3•Updated Nov 25, 2025Nov 25, 2025

• st2-cloud-pack

  Public
  A bespoke pack for SCD Cloud containing elements for managing Openstack and supporting infrastructure

  Python

  •

  GNU General Public License v3.0

  •5•0•12•3•Updated Nov 25, 2025Nov 25, 2025

• cloud-image-builders

  Public
  Builders for various cloud images

  Python

  •

  GNU General Public License v3.0

  •1•0•0•6•Updated Nov 25, 2025Nov 25, 2025

• fparser

  Public
  This project maintains and develops a Fortran parser called fparser2 written purely in Python which supports Fortran 2003 and some Fortran 2008. A legacy parser fparser1 is also available but is not supported. The parsers were originally part of the f2py project by Pearu Peterson.

  pythonparsingfortran

  Python

  •

  Other

  •42•69•99•2•Updated Nov 25, 2025Nov 25, 2025

• xrootd

  Public
  The XRootD central repository

  C++

  •

  Other

  •162•0•0•10•Updated Nov 25, 2025Nov 25, 2025

• cloud-helm-charts

  Public
  A Repository for storing helm charts created for the STFC Cloud

  Shell

  •

  Apache License 2.0

  •2•1•0•0•Updated Nov 25, 2025Nov 25, 2025

• CAPortal

  Public
  Java

  •

  Apache License 2.0

  •4•1•3•8•Updated Nov 25, 2025Nov 25, 2025

• cloud-capi-values

  Public
  Contains pre-set Cluster API values optimised for STFC Cloud deployments

  Shell

  •5•2•0•0•Updated Nov 24, 2025Nov 24, 2025

• cloud-docker-images

  Public
  Python

  •5•2•0•3•Updated Nov 24, 2025Nov 24, 2025

• cloud-azimuth-config

  Public
  Example configuration repository for Azimuth deployments.

  Shell

  •

  Apache License 2.0

  •15•1•0•3•Updated Nov 24, 2025Nov 24, 2025

• cloud-grafana-dashboards

  Public
  Grafana Dashboards for the STFC Cloud

  2•0•1•0•Updated Nov 24, 2025Nov 24, 2025

• stfc-gatus-status

  Public
  Shell

  •0•0•0•0•Updated Nov 24, 2025Nov 24, 2025

• aiida-chemshell

  Public
  An AiiDA plugin for the ChemShell multiscale computational chemistry software package.

  Python

  •

  BSD 3-Clause "New" or "Revised" License

  •2•1•2•0•Updated Nov 21, 2025Nov 21, 2025

• goldilocks

  Public
  Goldilocks aim to build an agent generating input for QE calculations

  Python

  •

  MIT License

  •2•1•23•8•Updated Nov 20, 2025Nov 20, 2025

• aiidalab-chemshell

  Public
  An AiiDAlab plugin for ChemShell based workflows

  Python

  •

  BSD 3-Clause "New" or "Revised" License

  •0•0•4•0•Updated Nov 20, 2025Nov 20, 2025

• openday-heatmap

  Public
  A heatmap for the Daresbury Openday.

  Jupyter Notebook

  •0•1•0•2•Updated Nov 19, 2025Nov 19, 2025

• aiida-mlip

  Public
  machine learning interatomic potentials aiida plugin

  Python

  •

  BSD 3-Clause "New" or "Revised" License

  •10•16•59•4•Updated Nov 17, 2025Nov 17, 2025

• janus-core

  Public
  Tools for machine learnt interatomic potentials

  Python

  •

  BSD 3-Clause "New" or "Revised" License

  •13•39•51•3•Updated Nov 17, 2025Nov 17, 2025

• pre-commit-hooks

  Public
  Custom pre-commit hooks for use within our projects

  Python

  •

  MIT License

  •0•2•14•1•Updated Nov 14, 2025Nov 14, 2025

• goldilocks_kpoints

  Public
  ML models to predict k-point distance for goldilocks project

  Jupyter Notebook

  •2•0•0•3•Updated Nov 13, 2025Nov 13, 2025

• alc-dls-exafs

  Public
  simple tools to merge simulations and exafs simulations, heavy dependent on xraylarch

  Python

  •

  BSD 3-Clause "New" or "Revised" License

  •1•1•11•0•Updated Nov 10, 2025Nov 10, 2025

• xrootd-utils

  Public
  utility scripts for xrootd ops

  Shell

  •0•0•0•0•Updated Nov 6, 2025Nov 6, 2025

• alc-ux

  Public
  alc ux project

  Python

  •

  BSD 3-Clause "New" or "Revised" License

  •2•0•9•0•Updated Nov 5, 2025Nov 5, 2025

• PSycloneBench

  Public
  Various benchmarks used to inform PSyclone optimisations

  benchmarkfortranoptimization+ 6openclopenmpmpigpu-accelerationopenacckokkos

  Fortran

  •

  BSD 3-Clause "New" or "Revised" License

  •5•6•23•5•Updated Oct 23, 2025Oct 23, 2025

• packuilon

  Public
  Scripts for building Glance images from Aquilon personalities

  packeropenstack

  Python

  •7•2•0•1•Updated Oct 21, 2025Oct 21, 2025

• iris-bench

  Public
  A GPU Monitoring and Carbon Calculation Tool for Benchmarks

  Python

  •0•1•0•3•Updated Oct 20, 2025Oct 20, 2025

• alc_trajectory

  Public
  A code to compute various dynamical correlation functions from MD trajectories of (non-)reactive systems, whose sizes are compatible with DFT. See a more detailed description in the README.md file

  Fortran

  •

  Other

  •1•1•1•0•Updated Oct 17, 2025Oct 17, 2025

• quantum-neo-dynamics

  Public
  Jupyter Notebook

  •

  Apache License 2.0

  •0•0•0•0•Updated Oct 15, 2025Oct 15, 2025