Communication Dans Un Congrès Année : 2023

From the calculation of the octahedral distortion to the use of machine learning for structure-properties relationships

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The role of the octahedral distortion of the coordination sphere around the Fe(II) ion has been proposed as a key parameter to tune the switching temperature of spin crossover molecules...

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hal-04630424 , version 1 (01-07-2024)

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Guilllaume Chastanet, Mathieu Marchivie, Philippe Guionneau, Cédric Desplanches, Rangsiman Ketkaew, et al.. From the calculation of the octahedral distortion to the use of machine learning for structure-properties relationships. 8th Phase Transition and Dynamical Properties of Spin Transition Materials Conference - PDSTM 2023, The University of Tokyo, Nov 2023, Kyoto, Japan. ⟨hal-04630424⟩
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