Yamanaka T, Hirai M, Komatsu Y
American Mineralogist 87 (2002) 1183-1189
Structure change of Ca1-xSrxTiO3 perovskite with composition and pressure
Sample: P = 4.1 GPa, Ca.35Sr.65TiO3
_database_code_amcsd 0002896
5.423 5.420 7.647 90 90 90 Pbnm
atom x y z occ Biso
Ca .969 .024 .25 .35 .76
Sr .969 .024 .25 .65 .76
Ti 0 .5 0 .62
O1 .035 .527 .25 1.43
O2 .765 .243 .011 1.32
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