Computational Chemist in CO2 Photoreduction at Ifp Energies Nouvelles

Há 2 dias


Porto, Porto, Portugal Ifp Energies Nouvelles (Ifpen) Tempo inteiro
About the Role

We are seeking a highly skilled computational chemist to join our team at Ifp Energies Nouvelles. As a postdoctoral researcher, you will be working on simulating opto-electronic properties of materials for CO2 photoreduction.

Job Description

This is a temporary full-time position with an estimated salary of €45,000 per year, based on the cost of living in Lyon, France. The contract will start on 1 October 2024 and end on 31 January 2025.

Responsibilities
  • Conduct density functional theory (DFT) calculations to simulate relevant BiOxFy materials properties
  • Undertake a bibliographic survey on theoretical methods applied to BiOxFy
  • Develop a systematic DFT analysis of BiOxFy bulk materials to identify thermodynamic stability and band gaps as a function of chemical compositions
  • Analyze surface properties of BiOxFy materials to determine conduction and valence bands levels as a function of surface crystallographic orientations
Requirements

To be successful in this role, you will need:

  • A PhD degree in theoretical chemistry or a related field
  • Strong skills with quantum computational codes and Python scripting
  • Excellent knowledge of catalysis concepts and materials science
Benefits

As a member of our team, you will have access to cutting-edge research facilities and collaboration opportunities with academic partners. You will also have the chance to work on a project that has the potential to make a significant impact in the field of CO2 photoreduction.



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