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the development of hierarchical computational materials discovery schemes combining random structure searching, machine learning, atomistic, and density functional theory (DFT) calculations to accurately and
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CFD methods DFT and Molecular modelling linked to CCUS Strong analytical and problem-solving skills, with an ability to interpret and analyze simulation and/or experimental results. Ability to work in
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Max Planck Institute for the Structure and Dynamics of Matter, Hamburg | Hamburg, Hamburg | Germany | about 5 hours ago
develop state-of-the-art theoretical and computational methods to model strong light–matter coupling in and out of equilibrium, across gaseous, liquid, and solid-state systems. Key responsibilities The PhD
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for the simulations with MD and DFT of zeolite catalytic processes, and will participate with the research group, to synchrotron coherent diffractive imaging experiments. This position is part of the funded FAPESP
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institution and they are allocated through recurrent internal calls). Preparation of scientific reports, journal articles and software documentation. Requirements: PhD in Physics, Materials Science, Chemistry
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-scale research facilities, such as synchrotrons, for EXAFS and high-pressure XPS measurements. We also work in close partnership with the CatTheory group, using DFT-calculations and microkinetic modelling
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deposition (ALD). The project involves performing quantum mechanical calculations (e.g., first principles density functional theory (DFT)) to identify the structures and to understand the complex mechanisms
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between catalysts and reactants. Write scientific reports and research articles and participate in conferences. Candidate Profile PhD degree in Chemical Engineering, Materials Science, or a related field
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national laboratories, providing excellent networking and career development prospects. Required Qualifications: PhD in Chemistry, Physics, Chemical Engineering, Materials Science, or related Disciplines
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CFD methods DFT and Molecular modelling linked to CCUS Strong analytical and problem-solving skills, with an ability to interpret and analyze simulation and/or experimental results. Ability to work in