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combine density functional theory (DFT), molecular simulations, and machine-learning force field (ML-FF) development to uncover the factors controlling NHC–surface interactions and to model realistic
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lie at the crossroads of multiple disciplines and involve expertise in optics, electronics, image and data processing (including machine learning), photophysics, chemistry and biology. The position is
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collaboration between the Exa-SofT and the Exa-DI projects and better support multi-linear algebra and tensor contractions in exascale CSE applications and Machine Learning. As part of the collaborative process
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