Tb5Sm2Er5
Alexandria ALEXAlex-ID: agm005649643 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_18_spg12
Tb2SmEr6 Tb4SmEr Tb(SmEr3)2
2023-06-19 07:36:49.436077
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005649643).
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 agm005649643
data_agm005649643
_cell_length_a 5.01268
_cell_length_b 7.93455
_cell_length_c 10.64681
_cell_angle_alpha 72.65382
_cell_angle_beta 76.38430
_cell_angle_gamma 71.58598
_cell_volume 378.81333
_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 0.50000 0.50000 0.50000 1.00000
Tb2 Tb 0.33382 0.33275 0.99962 1.00000
Tb3 Tb 0.41559 0.91841 0.25042 1.00000
Tb4 Tb 0.58441 0.08159 0.74958 1.00000
Tb5 Tb 0.66618 0.66725 0.00038 1.00000
Sm1 Sm 0.91695 0.41719 0.74892 1.00000
Sm2 Sm 0.08305 0.58281 0.25108 1.00000
Er1 Er 0.83219 0.83528 0.50034 1.00000
Er2 Er 0.24940 0.75142 0.74977 1.00000
Er3 Er 0.75060 0.24858 0.25023 1.00000
Er4 Er 0.16781 0.16472 0.49966 1.00000
Er5 Er 0.00000 0.00000 0.00000 1.00000
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