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quantum chemistry (DFT) and control engineering. PhD position in chemical reaction engineering (Kinetic modeling & thermal runaway) Supervisors: Sébastien Leveneur (sebastien.leveneur@ircelyon.univ-lyon1.fr
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. The first task will be to define a TD-DFT protocol for obtaining accurate gabs and glum values for nearly-isolated (i.e. solvated in apolar media) intrinsically chiral dyes. In a first phase, the PhD student
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of theory, which will greatly facilitate the subsequent benchmarks, especially at the TD-DFT level. Thanks to this, the PhD candidate will perform extensive electronic structure benchmarks considering a wide
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Programme? Horizon Europe Is the Job related to staff position within a Research Infrastructure? No Offer Description The PhD study will be conducted at the European Membrane Institute (Institut Européen des
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of oxygenates from CO and/or CO2, and mechanistic studies including operando spectroscopy and possibly numerical simulations (microkinetics, DFT). The objective is to discover new eco-efficient catalytic phases
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://www.diamond.ac.uk/Instruments/Mx/VMXi/Staff/Hough.html Details of Diamond Light Source and its studentship program may be found here: https://www.diamond.ac.uk/Home.html https://www.diamond.ac.uk/Careers/Students/PhD
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electrocatalysts. Main Tasks and responsibilities: The PhD position is framed within the MAIAMI project. The student will work on DFT and molecular dynamics simulations, generating structural and electronic
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presentations, and consortium meetings. Supervise junior student projects, where appropriate. Complete and defend a PhD thesis within four years. Where to apply Website https://www.academictransfer.com/en/jobs
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, visit: https://sites.google.com/view/tommaso-giovannini The ideal PhD candidate has: a solid background in theoretical/computational condensed-matter physics or chemistry (MSc in Physics, Chemistry
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resilient. The PhD student will take the lead on the full research programme: designing studies, analysing data, developing models, and co-producing interventions with DfT and other partners. The PhD student