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. 2023 Sep 19;9(10):e20270. doi: 10.1016/j.heliyon.2023.e20270

Table 1.

Parameters Cells determined by using PDXL Program.

x 0.3966 0.1586 0.0496 0.0347 0.0106 0.00
Cubiclattice
a(Å)
5.429 5.427 5.423 5.421 5.419 5.417
υ(positionparameter) 0.111 0.111 0.112 0.112 0.113 0.114
u(Sulfur
position)
0.389 0.389 0.388 0.388 0.387 0.386