Prediction and Rationalization of Site Preference of Rare Earth Elements in Fluorapatite from Density Functional Theory

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Authors: Smahane Dahbi, Angelika D. Rosa, Alain Manceau, Stephan N. Steinmann

Journal title: ACS Earth and Space Chemistry

Journal publisher: American Chemical Society (ACS)

Published year: 2025

DOI identifier: 10.1021/ACSEARTHSPACECHEM.5C00048

ISSN: 2472-3452