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Field
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for the simulation of non-adiabatic exciton transfer dynamics in light-harvesting complexes. The research will use a combination of quantum and molecular dynamics simulations, electronic structure calculations, and
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to challenging questions in the field of computational material design, especially with the help of CALPHAD-based methods. For further development of our simulation environment (https://github.com/cmatdesign
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Computational Biophysics/Chemistry (see also https://constructor.university/comp_phys ). The PhD position is focused on efficient algorithms for the simulation of non-adiabatic exciton transfer dynamics in light
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Collaborative Doctoral Project (PhD Position) - AI-guided design of scaffold-free DNA nanostructures
DNA thermodynamic database, coarse-grained simulations of DNA motifs, and existing experimental data to establish an AI model that is able to guide the construction of desired secondary structures
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applications. Your main tasks: Develop and integrate degradation models for multiscale and multiphysics simulations of solid oxide cells Validate models using experimental data (e.g. IV curves, EIS measurements
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degradation models for multiscale and multiphysics simulations of solid oxide cells Validate models using experimental data (e.g. IV curves, EIS measurements) Apply ML methods in combination with CFD
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synthesis over all relevant length scales (e.g. cutting-edge ab initio methods, atomistic simulation methods, multi-scale modelling, machine learning) • High resolution analysis, monitoring of chemistry
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of rainfall, drainage capacity, and 3D urban form on flood severity • Validate results with hydrodynamic simulations and 3D urban semantic models, benchmark against state-of-the-art methods, and publish in
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complexes” During my postdoc I discovered that the TREX-complex member and RNA clampase UAP56 functions at the heart of nuclear mRNA export and orchestrates nuclear remodeling steps through its ATP-dependent
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applications for a PhD Student or Postdoc Position (f/m/d) for any of the following topics: Combining non-equilibrium alchemistry with machine learning Free energy calculations for enzyme design Permeation and