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Delft University of Technology

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PhD Position in Molecular Modeling of Hydrogen Production Processes Delft University of Technology in Netherlands

Degree Level

PhD

Field of study

Chemistry

Funding

Full funding available

Deadline

Sep 20, 2026

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Country

Netherlands

University

Delft University of Technology

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Keywords

Chemistry
Environmental Science
Mechanical Engineering
Chemical Engineering
Materials Science
Molecular Modeling
Hydrogen Technology
Physics
Thermodynamics

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About this position

PhD position at Delft University of Technology (TU Delft) in the Faculty of Mechanical Engineering, working in the Process & Energy department on molecular modeling for hydrogen production processes.

The project focuses on accelerating the development of green and low-carbon hydrogen technologies by generating high-quality thermodynamic, transport, structural, and kinetic data for water electrolysers. The research will use hierarchical molecular simulations to study bulk electrolyte properties, membrane transport, visco-elastic behavior, and the catalyst-ionomer interface for both PEM and AEM electrolysis systems.

This opportunity is especially relevant for students interested in chemical engineering, mechanical engineering, physics, chemistry, and materials science, with a strong emphasis on thermodynamics, transport phenomena, and multiscale model development.

Eligibility highlights: an MSc in Mechanical, Chemical, Materials Engineering, Physics, or a related field; strong knowledge of mathematics, physics, chemistry, and thermodynamics; excellent English communication skills; ability to work independently and collaboratively; and a positive attitude. Prior experience with molecular simulation, ab-initio, or macroscale modeling is not required but is a plus.

Funding and conditions: this is a paid PhD employment position for 4 years in principle, with an initial 1.5-year contract and a possible 2.5-year extension. Salary is €3059–€3881 gross/month plus holiday allowance and end-of-year bonus. TU Delft also mentions health insurance discounts and relocation support for moving to the Netherlands.

Application deadline: 20 September 2026. Apply online through the TU Delft careers portal and upload a CV, motivational letter, and BSc/MSc grade list.

Funding details

Full funding including tuition fees and living expenses is available for this position. The scholarship covers all educational costs and provides a monthly stipend.

How to apply

Please submit your application including a cover letter, CV, academic transcripts, and contact information for two references. Applications should be sent via the online portal before the deadline.

More information can be found here

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