Tb3Pm6Mg
Alexandria ALEXAlex-ID: agm005991972 · Space group: P2/m (#10)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C6_1348_spg10
PmMg Tb5Pm3 Pm
2023-09-18 01:52:33
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005991972).
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 agm005991972
data_agm005991972
_cell_length_a 3.54594
_cell_length_b 7.35182
_cell_length_c 29.32588
_cell_angle_alpha 82.88597
_cell_angle_beta 97.19759
_cell_angle_gamma 118.86201
_cell_volume 662.49185
_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 0.45969 0.15102 0.79933 1.00000
Tb2 Tb 0.50000 0.50000 0.00000 1.00000
Tb3 Tb 0.54031 0.84898 0.20067 1.00000
Tb4 Tb 0.28726 0.49043 0.30101 1.00000
Tb5 Tb 0.00000 0.00000 0.50000 1.00000
Tb6 Tb 0.71274 0.50957 0.69899 1.00000
Pm1 Pm 0.20739 0.79475 0.90691 1.00000
Pm2 Pm 0.31043 0.71453 0.59366 1.00000
Pm3 Pm 0.54340 0.35291 0.19904 1.00000
Pm4 Pm 0.45660 0.64709 0.80096 1.00000
Pm5 Pm 0.68957 0.28547 0.40634 1.00000
Pm6 Pm 0.79261 0.20525 0.09309 1.00000
Pm7 Pm 0.68818 0.79267 0.39736 1.00000
Pm8 Pm 0.79485 0.70361 0.10351 1.00000
Pm9 Pm 0.71131 0.00621 0.70011 1.00000
Pm10 Pm 0.28869 0.99379 0.29989 1.00000
Pm11 Pm 0.20515 0.29639 0.89649 1.00000
Pm12 Pm 0.31182 0.20733 0.60264 1.00000
Mg1 Mg 0.50000 0.50000 0.50000 1.00000
Mg2 Mg 0.00000 0.00000 0.00000 1.00000
