Repositories list

• cloud-helm-charts

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

  Go Template

  •

  Apache License 2.0

  •3•1•0•15•Updated Mar 27, 2026Mar 27, 2026

• PSyclone

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

  pythoncompilerfortran+ 7

  pythoncompilerfortranoptimizationparallel-computinghigh-performance-computingfinite-elementsfinite-differencefinite-volumehacktoberfest

  Python

  •

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

  •33•132•685•30•Updated Mar 27, 2026Mar 27, 2026

• dl_py2f

  Public
  DL_PY2F: A library for Python-Fortran interoperability

  pythonfortran

  pythonfortran

  Python

  •

  GNU Lesser General Public License v3.0

  •0•3•1•0•Updated Mar 27, 2026Mar 27, 2026

• dl_py2f-example

  Public
  Fortran

  •

  GNU Lesser General Public License v3.0

  •0•1•1•1•Updated Mar 27, 2026Mar 27, 2026

• cloud-docker-images

  Public
  Python

  •4•2•0•6•Updated Mar 27, 2026Mar 27, 2026

• SCD-OpenStack-Utils

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

  Python

  •

  Apache License 2.0

  •12•1•0•3•Updated Mar 27, 2026Mar 27, 2026

• 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•2•Updated Mar 27, 2026Mar 27, 2026

• iris-bench

  Public
  A GPU Monitoring and Carbon Calculation Tool for Benchmarks

  Python

  •0•1•0•3•Updated Mar 27, 2026Mar 27, 2026

• quantum-molecular-encodings

  Public
  Data and codes used in Boy et al. (2025) - Quantum molecular structure encoding

  molecular-structuresquantum-computingquantum-machine-learning+ 2

  molecular-structuresquantum-computingquantum-machine-learningmolecular-representationencoding-algorithms

  Jupyter Notebook

  •

  Apache License 2.0

  •1•1•1•1•Updated Mar 26, 2026Mar 26, 2026

• 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•10•Updated Mar 26, 2026Mar 26, 2026

• quantum-neo-dynamics

  Public
  Jupyter Notebook

  •

  Apache License 2.0

  •0•1•0•3•Updated Mar 26, 2026Mar 26, 2026

• cloud-deployed-apps

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

  Shell

  •

  GNU General Public License v3.0

  •7•1•0•5•Updated Mar 26, 2026Mar 26, 2026

• goldilocks-mcp

  Public
  MCP-server exposing ML models for prediction of kpoints distance / kpoints grid for SCF DFT calculations trained on QE data for 3D crystalline inorganic materia…

  Python

  •2•3•0•1•Updated Mar 26, 2026Mar 26, 2026

• pam_oauth2_device

  Public
  PAM module OAuth2 Device flow

  C++

  •

  Apache License 2.0

  •44•15•13•1•Updated Mar 26, 2026Mar 26, 2026

• qiskit-machine-learning

  Public
  Quantum Machine Learning

  Python

  •

  Apache License 2.0

  •418•0•0•1•Updated Mar 26, 2026Mar 26, 2026

• lfric_core

  Public
  LFRic Infrastructure

  Fortran

  •

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

  •48•1•0•0•Updated Mar 25, 2026Mar 25, 2026

• lfric_apps

  Public
  LFRic Applications

  Fortran

  •

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

  •74•0•0•0•Updated Mar 25, 2026Mar 25, 2026

• aiidalab-chemshell

  Public
  An AiiDAlab plugin for ChemShell based workflows

  Python

  •

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

  •0•2•3•0•Updated Mar 24, 2026Mar 24, 2026

• goldilocks_kpoints

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

  Jupyter Notebook

  •

  Other

  •2•0•0•14•Updated Mar 24, 2026Mar 24, 2026

• cloud-image-builders

  Public
  Builders for various cloud images

  Shell

  •

  GNU General Public License v3.0

  •1•0•1•3•Updated Mar 24, 2026Mar 24, 2026

• xrootd

  Public
  The XRootD central repository

  C++

  •

  Other

  •168•0•0•12•Updated Mar 24, 2026Mar 24, 2026

• cloud-gatus-status

  Public
  Shell

  •1•0•0•1•Updated Mar 23, 2026Mar 23, 2026

• st2-replacement

  Public
  potential replacement for st2

  HTML

  •0•0•0•0•Updated Mar 23, 2026Mar 23, 2026

• janus-core

  Public
  Tools for machine learnt interatomic potentials

  Python

  •

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

  •17•44•41•8•Updated Mar 20, 2026Mar 20, 2026

• cloud-workshops

  Public
  A set of training docs and code used for cloud workshops and training

  HTML

  •0•0•0•0•Updated Mar 19, 2026Mar 19, 2026

• aiida-mlip

  Public
  machine learning interatomic potentials aiida plugin

  Python

  •

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

  •11•20•64•9•Updated Mar 19, 2026Mar 19, 2026

• 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…

  pythonparsingfortran

  pythonparsingfortran

  Python

  •

  Other

  •44•69•100•1•Updated Mar 19, 2026Mar 19, 2026

• cloud-capi-values

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

  Shell

  •6•2•0•3•Updated Mar 16, 2026Mar 16, 2026

• Netbox-utils

  Public
  Scripts and Utilities for querying and updating information in Netbox

  Python

  •

  Apache License 2.0

  •5•5•1•4•Updated Mar 16, 2026Mar 16, 2026

• goldilocks

  Public
  Goldilocks is an app https://goldilocks.streamlit.app/ for generation of input file for pw.x QE calculation (ML prediction of k-points is the main feature)

  Python

  •

  Other

  •2•1•2•12•Updated Mar 12, 2026Mar 12, 2026