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the use of foundational models. Predictions will be refined using DFT. - Collaboration with a PhD student (within the group) on mechanistic aspects and the screening of high-entropy alloys. This
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and DFT databases, and may collaborate with experimental groups to validate numerical predictions. Where to apply Website https://emploi.cnrs.fr/Offres/CDD/UMR8023-MARBOC-002/Default.aspx Requirements
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21 Aug 2026 Job Information Organisation/Company Babes-Bolyai University Research Field Chemistry Researcher Profile Established Researcher (R3) Positions PhD Positions Application Deadline 7 Sep
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deployment enabling validation and demonstration of real-world applications. For more details, please view https://www.ntu.edu.sg/erian We are looking for a Research Fellow to conduct Density Functional
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Materials, Bioinspired Materials and Sustainable Materials. For more details, please view https://www.ntu.edu.sg/mse/research . We are seeking a highly motivated and interdisciplinary Research Fellow
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could constitute exceptionally strong Lewis acids and enable the activation of otherwise poorly reactive substrates. An integrated approach combining classical molecular dynamics (cMD), DFT calculations
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Delft University of Technology (TU Delft) | Delft, Provincie Zuid-Holland | Netherlands | 20 days ago
PhD researcher, you will: Perform Density Functional Theory (DFT) calculations to model hydrogen-tramp element co-segregation at grain boundaries and phase boundaries Perform DFT to obtain atomistic
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materials, and the methods include DFT-simulations, machine learning potentials, Monte Carlo simulations and statistical analysis. We enjoy a close collaboration with experimental groups, both at the
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): Condensed Matter Physics, Topology, Non-Hermitian Systems, Statistical Physics https://sites.google.com/view/moonjippark/home - Prof. Sunwoo Kim (Hanyang University): DMFT, DFT, Strongly Correlated Electron
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key responsibilities will be to: perform first-principles/DFT studies of electrocatalytic reactions, catalyst surfaces and interfaces, reaction mechanisms, activity and selectivity develop