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. 2015 Jan 15;83:276–284. doi: 10.1016/j.actamat.2014.10.006

Table 2.

Ion positions of the orthorhombic β′-Ta2O5 structure with lattice parameters for two formula units in the c direction of a = 6.425 Å, = 3.769 Å and = 7.706 Å.

Ion x y z Occupancy
Ta1 0.00 0.00 0.00 1
Ta2 0.45 0.41 0.00 1
Ta3 0.00 0.91 0.50 1
Ta4 0.45 0.50 0.50 1
O1 0.98 0.95 0.25 1
O2 0.46 0.45 0.25 1
O3 0.11 0.47 0.00 1
O4 0.34 0.94 0.00 1
O5a 0.72 0.20 0.00 1
O6 0.98 0.95 0.75 1
O7 0.47 0.45 0.75 1
O8 0.11 0.44 0.50 1
O9 0.34 0.97 0.50 1
O5b 0.72 0.70 0.50 1