3 dft-simulation "https:" Postdoctoral positions at CNRS

Postdoctoral researcher (M/F) in theoretical chemistry for the prediction of superconducting hydrides using machine learning and DFT calculations

CNRS | Poitiers, Poitou Charentes | France | about 2 months ago

performing DFT/MLIP molecular dynamics simulations; - Analyzing and exploiting results, as well as writing activity reports and scientific publications and presenting results at conferences and working groups

M/F Post-Doc position in machine learning for the discovery of thermoelectric materials

CNRS | Montpellier, Languedoc Roussillon | France | about 1 month ago

to compute the predicted ZTs via first principles calculations. - Computer simulations: ML + DFT - Scripting (Python) - Analysis of the results + writing publications - The position is part of an ANR-DFG

M/F Postdoctoral researcher in EPR spectroscopy of metalloproteins

CNRS | Marseille 09, Provence Alpes Cote d Azur | France | about 2 months ago

) at multiple microwave frequencies. This work will be complemented by the systematic quantitative analysis of experimental data through spectral simulation, in combination with the use of various substrates