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[sdpd] Hypothetical AlF3 crystal structures

Preprint available about structure prediction by
GRINSP applied to MX3 compounds :

http://dx.doi.org/10.1016/j.jssc.2006.06.010
(depending on your access...).

Armel

PS - The 12 models in that publication were
extended to 33 after a second campaign of
exploration with GRINSP, enlarging the limits
of cell parameters from 16 to 30 A, and the
maximum of M atoms from 64 to 192.



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