Tb3Pm5Er2
Alexandria ALEXAlex-ID: agm005603631 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C5_183_spg15
PmEr2 Tb5Pm3 Pm
2023-06-25 06:01:28.711502
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005603631).
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 agm005603631
data_agm005603631
_cell_length_a 9.96988
_cell_length_b 9.96566
_cell_length_c 11.24314
_cell_angle_alpha 129.14350
_cell_angle_beta 129.15150
_cell_angle_gamma 64.90058
_cell_volume 671.24094
_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 0.22741 0.97742 0.95483 1.00000
Tb2 Tb 0.77259 0.02258 0.04517 1.00000
Tb3 Tb 0.72057 0.47452 0.25063 1.00000
Tb4 Tb 0.27943 0.52548 0.74937 1.00000
Tb5 Tb 0.03006 0.77611 0.25063 1.00000
Tb6 Tb 0.96994 0.22389 0.74937 1.00000
Pm1 Pm 0.27192 0.52192 0.04383 1.00000
Pm2 Pm 0.72808 0.47808 0.95617 1.00000
Pm3 Pm 0.02235 0.77235 0.54471 1.00000
Pm4 Pm 0.51935 0.26936 0.53871 1.00000
Pm5 Pm 0.97765 0.22765 0.45529 1.00000
Pm6 Pm 0.48065 0.73065 0.46129 1.00000
Pm7 Pm 0.88265 0.63506 0.75740 1.00000
Pm8 Pm 0.11735 0.36494 0.24260 1.00000
Pm9 Pm 0.37475 0.12234 0.75740 1.00000
Pm10 Pm 0.62525 0.87766 0.24260 1.00000
Er1 Er 0.77889 0.03245 0.75510 1.00000
Er2 Er 0.22112 0.96755 0.24490 1.00000
Er3 Er 0.47621 0.72265 0.75510 1.00000
Er4 Er 0.52379 0.27735 0.24490 1.00000
