Pm4Sm3Er4
Alexandria ALEXAlex-ID: agm009694313 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C4_15_spg47
Pm2SmEr6 PmSm2 Pm
2024-05-05 08:35:44.552575
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009694313).
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 agm009694313
data_agm009694313
_cell_length_a 19.94735
_cell_length_b 19.94735
_cell_length_c 5.04604
_cell_angle_alpha 82.73039
_cell_angle_beta 82.73039
_cell_angle_gamma 10.42871
_cell_volume 360.49052
_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
Pm1 Pm 0.45356 0.45356 0.04616 1.00000
Pm2 Pm 0.54644 0.54644 0.95384 1.00000
Pm3 Pm 0.18296 0.18296 0.31751 1.00000
Pm4 Pm 0.81704 0.81704 0.68249 1.00000
Sm1 Sm 0.36343 0.36343 0.13603 1.00000
Sm2 Sm 0.63657 0.63657 0.86397 1.00000
Sm3 Sm 0.00000 0.00000 0.50000 1.00000
Er1 Er 0.90848 0.90848 0.59109 1.00000
Er2 Er 0.72804 0.72804 0.77215 1.00000
Er3 Er 0.27196 0.27196 0.22785 1.00000
Er4 Er 0.09152 0.09152 0.40891 1.00000
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