La5Pm2YHo
Alexandria ALEXAlex-ID: agm005153290 · Space group: I4/mcm (#140)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D5_205_spg140
La7Y LaY2 LaHo2 LaPm
2023-01-19 19:25:21.781983
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005153290).
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 agm005153290
data_agm005153290
_cell_length_a 8.71392
_cell_length_b 8.71392
_cell_length_c 10.51247
_cell_angle_alpha 114.48510
_cell_angle_beta 114.48510
_cell_angle_gamma 90.00000
_cell_volume 646.74502
_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
La1 La 0.92472 0.42472 0.28675 1.00000
La2 La 0.63797 0.13797 0.71325 1.00000
La3 La 0.07528 0.57528 0.71325 1.00000
La4 La 0.13797 0.07528 0.71325 1.00000
La5 La 0.57528 0.63797 0.71325 1.00000
La6 La 0.86203 0.92472 0.28675 1.00000
La7 La 0.42472 0.36203 0.28675 1.00000
La8 La 0.36203 0.86203 0.28675 1.00000
La9 La 0.50000 0.50000 0.00000 1.00000
La10 La 0.00000 0.00000 0.00000 1.00000
Pm1 Pm 0.12212 0.37788 0.00000 1.00000
Pm2 Pm 0.62212 0.12212 1.00000 1.00000
Pm3 Pm 0.37788 0.87788 0.00000 1.00000
Pm4 Pm 0.87788 0.62212 0.00000 1.00000
Y1 Y 0.25000 0.75000 0.50000 1.00000
Y2 Y 0.75000 0.25000 0.50000 1.00000
Ho1 Ho 0.25000 0.25000 0.50000 1.00000
Ho2 Ho 0.75000 0.75000 0.50000 1.00000
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