Tb2Pm12Nd
Alexandria ALEXAlex-ID: agm005802442 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C12_72_spg12
Tb5Pm3 TbPmNd Pm
2023-07-17 17:34:11.884774
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005802442).
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 agm005802442
data_agm005802442
_cell_length_a 6.78524
_cell_length_b 6.78524
_cell_length_c 25.42952
_cell_angle_alpha 96.57654
_cell_angle_beta 96.57653
_cell_angle_gamma 115.58448
_cell_volume 1031.30133
_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 0.46175 0.96175 0.27460 1.00000
Tb2 Tb 0.94646 0.44646 0.27250 1.00000
Tb3 Tb 0.03825 0.53825 0.72540 1.00000
Tb4 Tb 0.55354 0.05354 0.72750 1.00000
Pm1 Pm 0.60996 0.58968 0.79845 1.00000
Pm2 Pm 0.08968 0.10996 0.79845 1.00000
Pm3 Pm 0.94450 0.94541 0.92755 1.00000
Pm4 Pm 0.39153 0.89153 0.85602 1.00000
Pm5 Pm 0.00365 0.98669 0.32855 1.00000
Pm6 Pm 0.10847 0.60847 0.14398 1.00000
Pm7 Pm 0.67683 0.17683 0.57789 1.00000
Pm8 Pm 0.48669 0.50365 0.32855 1.00000
Pm9 Pm 0.44541 0.44450 0.92755 1.00000
Pm10 Pm 0.55550 0.55459 0.07245 1.00000
Pm11 Pm 0.15796 0.18234 0.55572 1.00000
Pm12 Pm 0.82317 0.32317 0.42211 1.00000
Pm13 Pm 0.01331 0.99635 0.67145 1.00000
Pm14 Pm 0.34204 0.31766 0.44428 1.00000
Pm15 Pm 0.05459 0.05550 0.07245 1.00000
Pm16 Pm 0.81766 0.84204 0.44428 1.00000
Pm17 Pm 0.68234 0.65796 0.55572 1.00000
Pm18 Pm 0.89004 0.91032 0.20155 1.00000
Pm19 Pm 0.19982 0.69982 0.57514 1.00000
Pm20 Pm 0.49635 0.51331 0.67145 1.00000
Pm21 Pm 0.90134 0.40134 0.86712 1.00000
Pm22 Pm 0.41032 0.39004 0.20155 1.00000
Pm23 Pm 0.30018 0.80018 0.42486 1.00000
Pm24 Pm 0.59866 0.09866 0.13288 1.00000
Nd1 Nd 0.49573 0.99573 0.99554 1.00000
Nd2 Nd 0.00427 0.50427 0.00446 1.00000
