La2Pm2Th2Mg
Alexandria ALEXAlex-ID: agm017343247 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D2_117_spg119
LaPmMg2 LaPm LaTh4 Pm
2025-04-22 21:09:22
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017343247).
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 agm017343247
data_agm017343247
_cell_length_a 17.45378
_cell_length_b 17.45378
_cell_length_c 17.45378
_cell_angle_alpha 167.99438
_cell_angle_beta 167.99438
_cell_angle_gamma 17.00986
_cell_volume 230.03832
_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 0.20567 0.20567 0.00000 1.00000
La2 La 0.79433 0.79433 0.00000 1.00000
Pm1 Pm 0.06486 0.06486 0.00000 1.00000
Pm2 Pm 0.93514 0.93514 0.00000 1.00000
Th1 Th 0.36517 0.36517 0.00000 1.00000
Th2 Th 0.63483 0.63483 0.00000 1.00000
Mg1 Mg 0.50000 0.50000 0.00000 1.00000
Get direct link