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Application of XDM to ionic solids: The importance of dispersion for bulk moduli and crystal geometries

Author:
Otero de la Roza, AlbertoUniovi authority; Johnson, Erin R.
Publication date:
2020
Publisher version:
http://dx.doi.org/10.1063/5.0015133
Citación:
The Journal of Chemical Physics, 153(5) (2020); doi:10.1063/5.0015133
URI:
http://hdl.handle.net/10651/57553
ISSN:
1089-7690
DOI:
10.1063/5.0015133
Patrocinado por:

This research was funded by the Natural Sciences and Engineering Research Council of Canada (NSERC; Grant No. RGPIN-05795-2016) and the Spanish Government (Grant Nos. RyC-2016-20301, PGC2018-097520-A-100, and RED2018-102612-T).

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