TbY15O24
Alexandria ALEXAlex-ID: agm017574005 · Space group: C2 (#5)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB15C24_6_spg5
Tb11Y5O24 Y2O3
2025-01-28 12:28:59
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017574005).
Th. Cavignac, J. Schmidt, P.-P. De Breuck, A. Loew, T. F. T. Cerqueira, H.-C. Wang, A. Bochkarev, Y. Lysogorskiy, A. H. Romero, R. Drautz, S. Botti and M. A. L. Marques. AI-Driven expansion and application of the Alexandria database. J. Phys. Mater. 9, 025014 (2026). https://doi.org/10.1088/2515-7639/ae6620
@article{Cavignac2026Alexandria,
author = {Cavignac, Th{\'e}o and Schmidt, Jonathan and De Breuck, Pierre-Paul and Loew, Antoine
and Cerqueira, Tiago F. T. and Wang, Hai-Chen and Bochkarev, Anton
and Lysogorskiy, Yury and Romero, Aldo H. and Drautz, Ralf and Botti, Silvana
and Marques, Miguel A. L.},
title = {{AI}-Driven expansion and application of the {A}lexandria database},
journal = {Journal of Physics: Materials},
year = {2026},
volume = {9},
number = {2},
pages = {025014},
doi = {10.1088/2515-7639/ae6620},
url = {https://doi.org/10.1088/2515-7639/ae6620}
}3D Crystal Structure Rendering
Loading 3D structure…
# CIF generated by HEAS from Alexandria entry agm017574005
data_agm017574005
_cell_length_a 9.26854
_cell_length_b 9.26854
_cell_length_c 10.70242
_cell_angle_alpha 54.75962
_cell_angle_beta 125.24038
_cell_angle_gamma 109.44562
_cell_volume 613.29678
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Tb1 Tb 0.96754 0.96754 0.00000 1.00000
Y1 Y 0.03264 0.03264 0.50000 1.00000
Y2 Y 0.49981 0.00004 0.74984 1.00000
Y3 Y 0.21761 0.28291 0.71722 1.00000
Y4 Y 0.28291 0.21761 0.28278 1.00000
Y5 Y 0.25023 0.75006 0.46755 1.00000
Y6 Y 0.25001 0.75000 0.96732 1.00000
Y7 Y 0.00004 0.49981 0.25017 1.00000
Y8 Y 0.50034 0.00012 0.25028 1.00000
Y9 Y 0.00012 0.50034 0.74972 1.00000
Y10 Y 0.46738 0.46738 0.00000 1.00000
Y11 Y 0.53278 0.53278 0.50000 1.00000
Y12 Y 0.75000 0.25001 0.03268 1.00000
Y13 Y 0.75006 0.25023 0.53245 1.00000
Y14 Y 0.71716 0.78260 0.21731 1.00000
Y15 Y 0.78260 0.71716 0.78269 1.00000
O1 O 0.23970 0.54286 0.71861 1.00000
O2 O 0.26067 0.95754 0.52184 1.00000
O3 O 0.72788 0.96882 0.73813 1.00000
O4 O 0.03143 0.27180 0.23878 1.00000
O5 O 0.22811 0.46859 0.02068 1.00000
O6 O 0.53161 0.77174 0.52089 1.00000
O7 O 0.54286 0.23970 0.28139 1.00000
O8 O 0.95754 0.26067 0.47816 1.00000
O9 O 0.98882 0.77085 0.70733 1.00000
O10 O 0.23007 0.01137 0.20803 1.00000
O11 O 0.27085 0.48890 0.48919 1.00000
O12 O 0.51108 0.72930 0.98914 1.00000
O13 O 0.77085 0.98882 0.29267 1.00000
O14 O 0.72930 0.51108 0.01086 1.00000
O15 O 0.01137 0.23007 0.79197 1.00000
O16 O 0.48890 0.27085 0.51081 1.00000
O17 O 0.45722 0.76081 0.21846 1.00000
O18 O 0.04231 0.73886 0.02188 1.00000
O19 O 0.46859 0.22811 0.97932 1.00000
O20 O 0.77174 0.53161 0.47911 1.00000
O21 O 0.96882 0.72788 0.26187 1.00000
O22 O 0.27180 0.03143 0.76122 1.00000
O23 O 0.76081 0.45722 0.78154 1.00000
O24 O 0.73886 0.04231 0.97812 1.00000
