PSDI Investigator team

Juan Bicarregui

Juan Bicarregui

Position - Project PI

Juan Bicarregui is Head of the Data Division in the Scientific Computing Department at STFC. Juan heads up the investigator team ...

Barbara Montanari

Barbara Montanari

Position - Work Package 5 Lead

Barbara Montanari is Head of Computational Science and Engineering Division at STFC and Director of the Computational Science Centre ...

Simon Coles

Simon Coles

Position - Work Package 4 Lead

Simon Coles is Professor of Structural Chemistry and Director of both the UK National Crystallography Service and the UK Physical ...

Nicola Knight

Nicola Knight

Position - Project Coordinator / Work Package 2 Lead

Nicola Knight is a research fellow at the University of Southampton and will be coordinating activities across the pilot project and ...

Jeremy Frey

Jeremy Frey

Position - Work Package 1 Lead / Pathfinder 3 Lead

Jeremy Frey is Professor of Physical Chemistry and Head of Computational Systems Chemistry at University of Southampton. Jeremy takes ...

Vasily Bunakov

Vasily Bunakov

Position - Work Package 3 Lead

Vasily is a Researcher in the Scientific Computing Department at STFC.  Vasily takes the lead on the technical development in WP3 - ...

Brian Matthews

Brian Matthews

Position - Technical Architect

Brian Matthews is currently leader of the Data Science and Technology Group at STFC. He leads the DAFNI project, developing an ...

Samantha Pearman-Kanza

Samantha Pearman-Kanza

Position - Pathfinder 2 Lead

Samantha is a senior enterprise fellow at the University of Southampton.  She takes the lead on PF2 - Process Recording.

Abraham Nieva de la Hidalga

Abraham Nieva de la Hidalga

Position - Pathfinder 1 Lead

Dr Abraham Nieva de la Hidalga currently collaborates as a research associate at the UK Catalysis Hub. He is currently involved in the ...

Current Contributors

  • James Gebbie – STFC
  • Alin-Marin Elena – STFC
  • Sathya Sai Seetharaman – STFC
  • Chris Race – University of Sheffield
  • Kevin Ashley – University of Edinburgh
  • Leandro Liborio – STFC
  • Ian Bruno – CCDC
  • Amanda Chapman – STFC
  • Victoria Hooper – University of Southampton
  • Georgia Lomas – STFC
  • Aileen Day – University of Southampton
  • Alexander Belozerov – STFC
  • Catherine Jones – STFC
  • Jo Grundy – University of Southampton
  • Mark Anderson – University of Southampton
  • Patrick Austin – STFC
  • Clara Lines Diaz – University of Edinburgh
  • Cheney Ketley – STFC
  • Rose Dickinson – STFC
  • Noel Vizcaino – STFC
  • Tom Allam – University of Southampton
  • Samuel Munday – University of Southampton
  • Elliott Kasoar – STFC
  • Jonathan Bathe – STFC
  • Noel Vizcaino – STFC
  • Philip Leadbitter – University of Southampton
  • Silvia Chiacchiera – STFC
  • Frazer Barnsley – STFC
  • Stephen Gow – University of Southampton
  • Silvia Chiacchiera – STFC
  • Jas Kalayan – STFC
  • Cerys Willoughby – University of Southampton
  • Amali Pawula Hewage – STFC
  • Federica Zanca – STFC
  • Pamela Slingsby – STFC
  • Ray Whorley – University of Southampton
  • Tom Underwood – STFC
  • Stavrina Dimosthenous – University of Manchester

Previous Contributors

  • Alejandra Gonzalez Beltran – STFC
  • Gabin Kayumbi – STFC
  • Sally Bloodworth – University of Southampton
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