SmHo3Er4
Alexandria ALEXAlex-ID: agm016540477 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C4_345_spg12
Sm3(Ho2Er)2 HoEr5 Sm2Ho7
2025-04-01 20:21:56
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm016540477).
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 agm016540477
data_agm016540477
_cell_length_a 11.94042
_cell_length_b 11.94042
_cell_length_c 6.12379
_cell_angle_alpha 75.15782
_cell_angle_beta 104.84218
_cell_angle_gamma 162.93562
_cell_volume 247.46099
_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
Sm1 Sm 0.00000 0.00000 0.50000 1.00000
Ho1 Ho 0.50000 0.50000 0.00000 1.00000
Ho2 Ho 0.62586 0.37414 0.79127 1.00000
Ho3 Ho 0.37414 0.62586 0.20873 1.00000
Er1 Er 0.87430 0.12570 0.70980 1.00000
Er2 Er 0.12570 0.87430 0.29020 1.00000
Er3 Er 0.74953 0.25047 0.24967 1.00000
Er4 Er 0.25047 0.74953 0.75033 1.00000
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