Tb4Y7Er
Alexandria ALEXAlex-ID: agm003665528 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C7_85_spg12
Tb2Y7 Tb5Y Y5Er
2022-04-20 19:55:42.992084
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003665528).
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 agm003665528
data_agm003665528
_cell_length_a 5.87557
_cell_length_b 11.63781
_cell_length_c 6.72047
_cell_angle_alpha 83.48841
_cell_angle_beta 64.07848
_cell_angle_gamma 75.37837
_cell_volume 399.91753
_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 0.64262 0.22428 0.49049 1.00000
Tb2 Tb 0.35738 0.77572 0.50951 1.00000
Tb3 Tb 0.76977 0.67280 0.78766 1.00000
Tb4 Tb 0.23023 0.32720 0.21234 1.00000
Y1 Y 0.78863 0.92396 0.49878 1.00000
Y2 Y 0.21137 0.07604 0.50122 1.00000
Y3 Y 0.06618 0.68754 0.18011 1.00000
Y4 Y 0.93382 0.31246 0.81989 1.00000
Y5 Y 0.36736 0.49680 0.76848 1.00000
Y6 Y 0.50000 0.00000 0.00000 1.00000
Y7 Y 0.63264 0.50320 0.23152 1.00000
Er1 Er 0.00000 0.00000 0.00000 1.00000
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