| Exp_1GPa | ||||||
|---|---|---|---|---|---|---|
| ADPs | U 11 | U 22 | U 33 | U 12 | U 13 | U 23 |
| Ca | 0.00595 (7) | 0.00595 (7) | 0.00381 (9) | 0.00086 (5) | 0 | 0 |
| Si | 0.00358 (9) | 0.00358 (9) | 0.00333 (12) | 0 | 0 | 0 |
| Al | 0.0026 (1) | 0.0026 (1) | 0.0026 (1) | −0.00012 (6) | −0.00012 (6) | −0.00012 (6) |
| O | 0.00448 (14) | 0.00596 (14) | 0.00505 (14) | 0.00043 (10) | 0.00062 (10) | −0.00032 (10) |
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