4 molecular-dynamics-simulation PhD positions at CNRS

PhD in molecular simulation of membrane proteins (M/F)

CNRS | Orsay, le de France | France | about 22 hours ago

from E. coli using molecular simulations to understand electron transfer between the second heme b and heme d [4]. To this end, we performed molecular dynamics simulations of the protein within a

PhD position (M/F) : Quantum Mechanical Investigation of Light-to-Mechanical Energy Conversion in Molecular Photoswitches.

CNRS | Paris 13, le de France | France | 1 day ago

systems (LIED, Université Paris Cité), experts in classical atomistic simulations (molecular dynamics and coarse-graining, LMCE, CEA/DAM/DIF), as well as specialists in continuum simulations (finite element

PhD Candidate (M/F) in Physical Chemistry and Materials Science: Experimental and Theoretical Study of CO₂ and H₂ Adsorption in Type I Porous Liquids

CNRS | Montpellier, Languedoc Roussillon | France | 14 days ago

at the molecular scale. Grand Canonical Monte Carlo (GCMC) simulations will be performed to predict adsorption isotherms and selectivities. Molecular dynamics simulations will be used to investigate diffusion

M/F PhD position on phase-field modeling of solidification microstructures in aluminum alloys

CNRS | Palaiseau, le de France | France | 1 day ago

physical parameters, namely the anisotropies and the diffusion coefficients, will be obtained from molecular dynamics calculations in collaboration with Science et Ingénierie, Matériaux, Procédés (SIMAP