Recent developments in the Inorganic Crystal Structure Database: theoretical crystal structure data and related features

By D. Zagorac, H. Müller, S. Ruehl, J. Zagorac, Silke Rehme. Journal of Applied Crystallography, 2019

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The article discusses how theoretical crystal data are supplementing experimental data for simulation and prediction of structures of inorganic solids in the Inorganic Crystal Structure Database.

Subfields: Electronic, Optical and Magnetic Materials, Materials Chemistry

View Paper: https://www.semanticscholar.org/paper/886c97d3c322e59ca25627e0741e8f0baa971828