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, C.; Pineau, N.; Perrier, A. J. Chem. Theory Comput. 2020, 16 (11), 7017–7032 https://doi.org/10.1021/acs.jctc.0c00762 . (b) Villegas, O.; Serrano Martínez, M.; Le Bras, L.; Ottochian, A.; Pineau, N
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mechanisms in porous liquids. Density Functional Theory (DFT) calculations will allow analysis of specific interactions between gas molecules and POSS cages. **Scientific Environment** The PhD will be carried
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the partner teams and a theory/experiment dialog will allow to enrich the project. The person recruited will have the opportunity to use a large panel of theoretical chemistry and molecular modeling methods
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international conferences. h.Training: Develop mastery of stability theory, machine learning, reduced-order modelling and high-performance computing. The candidate must hold a Master's degree in Fluid Mechanics
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. FeelGoodAI will be applied to the field of education, where learner mental health and well-being are major concerns. Multiple perspectives and constructs related to well-being underpin several theories from
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, Spain) and Christoph Stampfer (RWTH Aachen, Germany). The successful candidate will join the Laboratoire Ondes et Matière d'Aquitaine (LOMA) in Bordeaux, within the condensed matter theory team
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mixing in appropriate representations, while optical spectral mixtures are commonly approximately described by Kubelka–Munk theory or related radiative transfer approximations. These physical laws will
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collaboration (neuroscience, artificial intelligence, cognitive psychology) and aims to develop a novel theory of auditory scene analysis in the brain and in machines. In Marseille, the group focuses