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Fritz Haber Institute of the Max Planck Society, Berlin | Berlin, Berlin | Germany | about 3 hours ago
-ray beamline instrumentation. Experience in simulating X-ray absorption spectra (e.g., Finite Difference Method Near Edge Structure - FDMNES) Experience with density functional theory (DFT) calculations
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, Ansys, Lumerical, or Sonnet Experience with electronic design automation (EDA) tools Experience working with ab-initio methods for materials simulation e.g. Density Functional Theory (DFT) Experience
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. The ideal candidate will have a strong background in modeling and simulation of atomic and molecular structures, along with extensive experience in analyzing the electronic and structural properties
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physical techniques. Responsibilities and tasks: • In-depth and extensive bibliographic study; • Optimization of the crystal growth process through numerical models; • DFT and DFT+eDMFT studies
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be possible; and modeling results will be used to interpret experimental data and to guide subsequent experimental work. key words DFT; 2D materials; Electronic devices; Simulation; Transport
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DFT, beyond-DFT, and experimental techniques. We are also interested in developing both forward and inverse machine learning models to accelerate and optimize the design processes. We work in close
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magnets, unconventional magnetic systems, and topological materials. The candidate will develop and apply advanced computational techniques, including (TD)DFT and post-DFT analyses, alongside spin dynamics
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) The overall following data and analyses of the different physical effects (orbital vs. Spin contribution) will be accompanied by the development of advanced theory/model/numerical simulations and possibly DFT
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Density Functional Theory (DFT)—frequently fail to balance the necessary accuracy with the required computational scale. Our group is developing a high-performance computational framework to bridge this gap
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IT4Innovations National Supercomputing Center, VSB - Technical University of Ostrava | Czech | 24 days ago
No. 24-11388I - Magneto-elasticity of non-cubic materials in spin-lattice dynamic simulations. Activity description: · conduct scientific investigations in two primary research directions: - development