Sort by
Refine Your Search
-
Listed
-
Category
-
Country
-
Field
-
proficiency in Density Functional Theory (DFT) and/or Molecular Dynamics (MD) simulations, enabling the computational investigation of material properties, electronic structure, and atomic-scale behavior
-
calculations and Brownian Dynamics simulations. The group is looking for a highly motivated and driven postdoctoral researcher to contribute strongly to a wave of ongoing developments deploying this technology
-
calculations and Brownian Dynamics simulations. The group is looking for a highly motivated and driven postdoctoral researcher to contribute strongly to a wave of ongoing developments deploying this technology
-
experience with multiscale modelling of materials - previous experience with molecular dynamics simulations Applications should be sent by e-mail, together with significant documents, indicating the reference
-
properties of Li-rich three-dimensional materials for lithium battery cathodes using density functional theory (DFT), molecular dynamics, cluster expansion, machine learning computational techniques. This work
-
of very large data sets, data analysis, and simulations of X-ray scattering and spectroscopy signatures of dynamic processes in battery materials. The theoretical/ simulation efforts are supported by
-
advanced characterization methods of inorganic materials and their assemblies, ideally with a focus on battery materials. Demonstrated proficiency in Density Functional Theory (DFT) and/or Molecular Dynamics
-
assemblies, ideally with a focus on battery materials. Demonstrated proficiency in Density Functional Theory (DFT) and/or Molecular Dynamics (MD) simulations, enabling the computational investigation
-
molecular dynamics, docking (e.g., IFD), metadynamics, and free energy perturbation (FEP) techniques. Construct and contribute to the development of software tools for simulation and analysis. Integrate and
-
and reduction of very large data sets, data analysis, and simulations of X-ray scattering and spectroscopy signatures of dynamic processes in battery materials. The theoretical/ simulation efforts