Tb7(PmTh2)2
Alexandria ALEXAlex-ID: agm005643114 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B4C7_85_spg2
Tb5Pm3 Tb2Th3 Tb2Th
2023-06-15 09:22:22.191022
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005643114).
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 agm005643114
data_agm005643114
_cell_length_a 8.00666
_cell_length_b 14.75821
_cell_length_c 6.19856
_cell_angle_alpha 82.02902
_cell_angle_beta 97.37041
_cell_angle_gamma 144.32575
_cell_volume 422.86331
_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 0.76751 0.53749 0.61180 1.00000
Tb2 Tb 0.23249 0.46251 0.38820 1.00000
Tb3 Tb 0.00000 0.00000 0.00000 1.00000
Tb4 Tb 0.46314 0.92486 0.76607 1.00000
Tb5 Tb 0.53686 0.07514 0.23393 1.00000
Tb6 Tb 0.85163 0.69560 0.07845 1.00000
Tb7 Tb 0.14837 0.30440 0.92155 1.00000
Pm1 Pm 0.68626 0.37970 0.15823 1.00000
Pm2 Pm 0.31374 0.62030 0.84177 1.00000
Th1 Th 0.92751 0.85062 0.53554 1.00000
Th2 Th 0.07249 0.14938 0.46446 1.00000
Th3 Th 0.60373 0.22631 0.68576 1.00000
Th4 Th 0.39627 0.77369 0.31424 1.00000
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