npj Computational Materials

ISSN: 2057-3960
Publisher: Nature Research

Publications (18)

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Unpublished / Preprint

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Abstract

Accelerating materials-space exploration for thermal insulators by mapping materials properties via artificial intelligence (2023) Purcell TA, Scheffler M, Ghiringhelli LM, Carbogno C Journal article Automatic identification of crystal structures and interfaces via artificial-intelligence-based electron microscopy (2023) Leitherer A, Yeo BC, Liebscher CH, Ghiringhelli LM Journal article Numerical quality control for DFT-based materials databases (2022) Carbogno C, Thygesen KS, Bieniek B, Draxl C, Ghiringhelli LM, Gulans A, Hofmann OT, et al. Journal article Finding predictive models for singlet fission by machine learning (2022) Liu X, Wang X, Gao S, Chang V, Tom R, Yu M, Ghiringhelli LM, Marom N Journal article The NOMAD Artificial-Intelligence Toolkit: turning materials-science data into knowledge and understanding (2022) Sbailò L, Fekete Á, Ghiringhelli LM, Scheffler M Journal article Computational screening of materials with extreme gap deformation potentials (2022) Borlido P, Schmidt J, Wang HC, Botti S, Marques MAL Journal article Hybrid magnetorheological elastomers enable versatile soft actuators (2022) Moreno Mateos MA, Hossain M, Steinmann P, Garcia-Gonzalez D Journal article Predicting stable crystalline compounds using chemical similarity (2021) Wang HC, Botti S, Marques MAL Journal article Sign-reversible valley-dependent Berry phase effects in 2D valley-half-semiconductors (2021) Zhou X, Zhang RW, Zhang Z, Feng W, Mokrousov Y, Yao Y Journal article Different types of spin currents in the comprehensive materials database of nonmagnetic spin Hall effect (2021) Zhang Y, Xu Q, Koepernik K, Rezaev R, Janson O, Zelezny J, Jungwirth T, et al. Journal article