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theoretical and practical limitations. Their results are often plagued by false positives (reporting problems that are not real) and false negatives (missing real issues). This PhD project aims to improve
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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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) simulations will also be performed for the investigations. Furthermore, machine learning can be tested to accelerate MD simulations. In this project, you will be responsible for the following tasks in
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tools for static and dynamic analysis are powerful for detecting vulnerabilities, they suffer from both theoretical and practical limitations. Their results are often plagued by false positives (reporting
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, covering from understanding the phenomenology of plant behaviour beyond their design basis to the application of the most recent methodologies for treating uncertainties in realistic simulations, both
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sources compared with gas turbines, etc. The aim of this PhD research is to develop novel performance simulation capabilities to support the analysis and optimization for sCO2 power generation systems
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demands. To break this bottleneck and cut simulation time by orders of magnitude, you will design and implement surrogate models that learn the behavior of full‑physics codes using modern machine‑learning
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of an external magnetic field into the phase-field model and to simulate the microstructural evolution for different cooling rates. - Phase-field modeling of the phase transition in the Fe-Ni alloy. The selected
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-language models, or diffusion models to simulate and design complex urban traffic environments? Do you want to shape the next generation of data-driven mobility intelligence with your creative ideas and
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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