Postdoctoral Researcher in Hydrogen Storage, Trinity College Dublin, Ireland

Postdoc in Ireland

Postdoctoral Researcher in Hydrogen Storage: The Computational Chemistry Group at Trinity College Dublin (TCD), under the leadership of Prof. Graeme Watson, invites applications for a postdoctoral position in computational materials science. The position is part of the EU-funded project PeCATHS, focusing on green hydrogen production and biomass valorisation. The role emphasizes computational modelling of (electro)catalysts using periodic Density Functional Theory (DFT) and offers an exciting opportunity to work with an international consortium of academic and industrial leaders.

Postdoctoral Researcher in Computational Materials Design for Hydrogen Storage


Summary Table:

FieldDetails
DesignationPostdoctoral Researcher
Research AreaComputational Materials Design, Catalysis, Hydrogen Storage
LocationTrinity College Dublin, Ireland
Salary€44,347 per annum (Point 1, IUA Postdoc Scale)
Start Date1st September 2025 (or as soon as possible thereafter)
Contract Duration18 months (possibility of 12-month extension)
Application DeadlineNot specified – early application encouraged
ProjectPeCATHS (EU-funded)

Designation:

Postdoctoral Researcher


Research Area:

  • Computational Materials Design
  • Periodic DFT Simulations
  • (Electro)Catalysis and Biomass Conversion
  • Hydrogen Storage Materials

Location:

Computational Chemistry Group,
Trinity College Dublin (TCD),
Ireland


Eligibility/Qualification:

Essential:

  • PhD in Computational Materials Science, Theoretical Chemistry, or a related discipline
  • Proven expertise in periodic Density Functional Theory (DFT)
  • Strong English communication skills (written and verbal)
  • Ability to work independently and as part of a team

Desirable:

  • Experience in modelling catalytic and/or electrocatalytic processes
  • Knowledge of hydrogen storage materials
  • Familiarity with multi-partner or international collaborative research projects

Job Description:

As a Postdoctoral Researcher, you will:

  • Model resting states of photo- and electrocatalysts under experimental conditions
  • Perform mechanistic studies on biomass conversion to liquid organic hydrogen carriers (LOHCs)
  • Screen and optimize catalyst materials to improve performance and stability
  • Collaborate closely with CIC energiGUNE and other PeCATHS partners
  • Contribute to research planning, publications, and presentations
  • Co-supervise and mentor postgraduate students

This is a research-intensive role involving frequent collaboration across the PeCATHS consortium, including partners from University Jaume I, CIC energiGUNE, ICN2-CERCA, University of Zurich, and others.


How to Apply:

Interested applicants should email the following documents to Prof. Graeme Watson at watsong@tcd.ie:

  • A cover letter outlining motivation and suitability
  • Full Curriculum Vitae (CV)
  • Contact information for two referees

Informal enquiries are welcome and can be directed to Prof. Watson at the above email address.


Last Date to Apply:

Rolling basis – early applications are highly encouraged.


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