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inviting applications for a PhD Student (f/m/x) in the field of Theory and Methods for Non-equilibrium Theory and Atomistic Simulations of Complex Biomolecules Possible projects are variational free energy
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environment featuring a wide range of research activities, including QM/MM simulations, ionic liquid simulations, and excited-state characterization. The aim of this PhD thesis is the atomistic modeling
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-free double perovskites Your Profile: Master`s degree in theoretical or computational physics, chemistry, materials science or similar fields Familiarity with atomistic simulations, high-performance
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models for atomistic systems (in chemistry or physics) is advantageous. The applicant should furthermore have a strong drive towards performing fundamental research; the ability and interest to work
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in a suitable software environment, with documented experience. Experience in applying or developing machine learning models for atomistic systems (in chemistry or physics) is advantageous
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analysis methods. You will gain expertise in integrating experimental total scattering and high-resolution imaging data with artificial intelligence and atomistic simulation tools to overcome current
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atomistic simulations, high-performance computing, and the application of AI-based methods Basic knowledge in photovoltaics and solid-state materials for energy application Ability to work individually and in
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, or related fields Good English language – spoken and written Nice-to-have: Experience with molecular dynamics simulations (with GROMACS, CHARMM, NAMD, AMBER, LAMMPS, etc.) at the atomistic or coarse-grained
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(with GROMACS, OPENMM, LAMMPS, NAMD, AMBER, etc.) at the atomistic or coarse-grained level would are advantageous. Good communication and interpersonal skills Motivation and a collaborative mindset What
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) Atomistic classical simulations of macromolecules (v) Biophysics. You can write computer codes to solve some of the daily research problems and have experience with high performance computing. You should have