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more than 300 researchers, engineers, and students working across analytical chemistry, physico‑chemistry, environmental science, and materials science. CAPT combines quantum chemistry, molecular dynamics
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Multiphysics software (COMSOL and/or Abaqus), python/matlab coding and Molecular Dynamics Simulator (LAMMPs). 4. Publications in mechanical metamaterials, soft robotics, or related area in peer-reviewed
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We are seeking a Postdoctoral Research Associate to support our projects to understand membrane evolution. The aim of this project is to use molecular dynamic simulations to understand membrane
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simulations to identify key mechanistic drivers of viral persistence and immune response, and use SciML to automatically select ODE/PDE models that include these mechanisms. The postdoc will develop
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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
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their thermophysical properties. Proficiency in computational fluid dynamics (CFD) simulation of thermal energy storage systems, enabling the modeling and analysis of heat transfer, fluid flow, and thermodynamic
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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
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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
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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
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) analysis Mathematical modelling Microbiology Molecular biology We approach science with the view of physics, aiming to identify principles behind complex systems. We collaborate closely with engineers