Thorogood G J, Kennedy B J, Griffith C S, Elcombe M E, Avdeev M,
Hanna J V, Thorogood S K, Luca V
Chemistry of Materials 22 (2010) 4222-4231
Structure and phase transformations in the titanosilicate, sitinakite.
The importance of water
Locality: synthetic
Note: T = 298 K with neutron
_database_code_amcsd 0012223
7.8099 7.8099 11.956 90 90 90 P4_2/mcm
atom x y z Biso
Na1 0 .5 .5 7
Na2 .27 .27 0 3
Na3 .5 .5 .38 3
Ti .147 .147 .160 1.7
Si 0 .5 .25 2.6
O1 .127 .384 .1710 .9
O2 .109 .109 .327 .9
O4 .147 .147 0 .9
O(W1) .294 .294 .5 9
O(W2) .439 .439 .333 3
D(W1) .217 .217 .445 6.2
D(W2) .439 .439 .124 6
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