Sm3DyEr4
Alexandria ALEXAlex-ID: agm017606262 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C4_467_spg12
Sm3(DyEr2)2 Sm2DyEr6 Sm
2025-03-07 13:25:39
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017606262).
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
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# CIF generated by HEAS from Alexandria entry agm017606262
data_agm017606262
_cell_length_a 12.04940
_cell_length_b 12.04940
_cell_length_c 6.17152
_cell_angle_alpha 75.14449
_cell_angle_beta 104.85551
_cell_angle_gamma 162.94465
_cell_volume 253.81679
_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 0.50000 0.50000 0.50000 1.00000
Sm2 Sm 0.12602 0.87398 0.79102 1.00000
Sm3 Sm 0.87398 0.12602 0.20898 1.00000
Dy1 Dy 0.00000 0.00000 0.00000 1.00000
Er1 Er 0.37427 0.62573 0.70920 1.00000
Er2 Er 0.62573 0.37427 0.29080 1.00000
Er3 Er 0.24885 0.75115 0.24987 1.00000
Er4 Er 0.75115 0.24885 0.75013 1.00000
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