@article{10272/16089,
year = {2017},
month = {12},
url = {http://hdl.handle.net/10272/16089},
abstract = {Schwertmannite is a poorly crystalline nanometric iron sulfate oxyhydroxide. This mineral shows a structural variability under different environments. Because of that, the determination of its structure and, consequently, of its physical–chemical properties is quite challenging. This article presents a detailed structural investigation of the structure of schwertmannite conducted under different approaches: X-ray absorption spectroscopy, Rietveld refinement, and a combined reverse Monte Carlo and Debye function analysis of the whole nanoparticle structure. The schwertmannite model presented here is, to the auhors' knowledge, the most complete model so far reported.},
organization = {This work has been supported by a grant from Labex OSUG@2020 (Investissements d'avenir - ANR10 LABX56). SC was partially funded by a 'Nano Espagne' fellowship (Campus France).},
publisher = {International Union of Crystallography},
title = {Whole-nanoparticle atomistic modelling of the schwertmannite structure from total scattering data},
doi = {https://doi.org/10.1107/S160057671701336X},
author = {Sestu, M. and Navarra, G. and Carrero Romero, Sergio and Valvidares, S. M. and Aquilanti, G. and Pérez López, Rafael and Fernández Martínez, Alejandro},
}