Tb3CePm2
Alexandria ALEXAlex-ID: agm005692685 · Space group: Imma (#74)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_865_spg12
Pm Ce Tb5Pm3
2023-08-29 13:04:23.064460
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005692685).
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 agm005692685
data_agm005692685
_cell_length_a 5.06076
_cell_length_b 9.48633
_cell_length_c 9.48633
_cell_angle_alpha 106.85177
_cell_angle_beta 105.48464
_cell_angle_gamma 105.48464
_cell_volume 389.66405
_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 0.49480 0.82690 0.66240 1.00000
Tb2 Tb 0.99480 0.66240 0.82690 1.00000
Tb3 Tb 0.50000 0.50000 0.00000 1.00000
Tb4 Tb 0.50520 0.17310 0.33760 1.00000
Tb5 Tb 0.00000 0.00000 0.50000 1.00000
Tb6 Tb 0.00520 0.33760 0.17310 1.00000
Ce1 Ce 0.25000 0.41917 0.58083 1.00000
Ce2 Ce 0.75000 0.58083 0.41917 1.00000
Pm1 Pm 0.25000 0.08298 0.91702 1.00000
Pm2 Pm 0.25000 0.74843 0.25157 1.00000
Pm3 Pm 0.75000 0.91702 0.08298 1.00000
Pm4 Pm 0.75000 0.25157 0.74843 1.00000
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