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. 2019 Jun 21;6(Pt 4):740–750. doi: 10.1107/S2052252519007711

Table 1. The dimensions and global amplitudes of distortive modes observed in the Pmca and Pmc21 structures.

The q vector basis refers to the Ammm and pseudo-cubic perovskite structures.

Wavevector q     Dimension A τ (Å)
Ammm Pseudo-cubic q i Irrep Pmca Pmc21 Pmca Pmc21
[0 0 0]* [0 0 0]p* q 0 Γ4−   5   0.21
[1/4 0 0]* [0 0 1/4]p* q 1 Λ1   4   0.09
[1/4 0 0]* [0 0 1/4]p* q 2 Λ3 5 5 0.48 0.47
[0 1 0]* [1/2 1/2 0]p* q 3 Y2+   2   0.17
[0 1 0]* [1/2 1/2 0]p* q 4 Y3− 3 3 0.16 0.16
[1/2 0 0]* [0 0 1/2]p* q 5 Z3+   2   0.03
[1/2 0 0]* [0 0 1/2]p* q 6 Z2− 2 2 0.04 0.02
[1/2 1 0]* [1/2 1/2 1/2]p* q 7 T4+ 3 3 1.23 1.22
[1/4 1 0]* [1/2 1/2 1/4]p* q 8 H2 2 2 1.00 0.97
[1/4 1 0]* [1/2 1/2 1/4]p* q 9 H4   4   0.11