10.60732/1c1bf708

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HO_LiMoNiTi_NPJCM_2020_LiMoNiTi_train Dataset

April M. Cooper, Johannes Kästner, Alexander Urban, Nongnuch Artrith,
Training configurations of Li8Mo2Ni7Ti7O32 from HO_LiMoNiTi_NPJCM_2020 used in the training of an ANN, whereby total energy is extrapolated by a Taylor expansion as a means of reducing computational costs.

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