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scheme. Eligibility criteria Qualification criteria: - Scientific achievements in the field of density functional theory research on hard magnetic materials and thin films; - Knowledge of theoretical
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density functional theory, and atomic-scale simulations to investigate the decomposition of polymers using zeolite catalysts. The successful candidate will employ a combination of density functional theory
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local structure and composition to catalytic behavior. By bridging atomistic theory and machine learning, the work will help explain activity trends and guide the rational design of alloy catalysts
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Recent advances in quantum materials research rely increasingly on the close integration of experimental and theoretical approaches. First-principles methods, particularly density functional theory (DFT
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density functional theory (DFT) The opportunity to be part of an exciting project and part of a multidisciplinary, enthusiastic and supportive team To grow your career through opportunities such as formal
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, IsoNET, deepDeWedge, and Topaz for denoising and missing-data compensation in simulated and experimental cryoET data. Run sub-tomogram alignment and averaging for reconstruction of 3D density
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Cluster Contact: Pr. Johan Jacquemin – johan.jacquemin@um6p.ma Research Activities Develop independent research programs bridging experimental and Density Functional Theory (DFT) simulation of materials
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the Warsaw University of Technology/the Centre for Advanced Materials and Technologies, CEZAMAT | Poland | about 19 hours ago
properties of various systems involving atomistic and continuous methodologies such as: (i) ab initio methods in the framework of density functional theory (DFT) and employing various numerical packages, (ii
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the Warsaw University of Technology/the Centre for Advanced Materials and Technologies, CEZAMAT | Poland | 4 days ago
the framework of density functional theory (DFT) and employing various numerical packages, (ii) tight-binding methods, (iii) valence force field methods, (iv) effective hamiltonians for electronic and magnetic
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candidate would lead dynamic research in materials simulations, developing and applying a range of methodologies. Current strengths of the institute are to be continued. These include density functional