Sm3Y4Ho5
Alexandria ALEXAlex-ID: agm003382425 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C5_46_spg12
Sm3(Y2Ho)2 Y5Ho SmHo5
2022-02-12 09:36:27.196494
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003382425).
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 agm003382425
data_agm003382425
_cell_length_a 5.91190
_cell_length_b 8.51902
_cell_length_c 9.64695
_cell_angle_alpha 105.65771
_cell_angle_beta 72.15680
_cell_angle_gamma 69.69713
_cell_volume 393.35829
_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 0.52370 0.68508 0.26751 1.00000
Sm2 Sm 0.00000 0.50000 0.50000 1.00000
Sm3 Sm 0.47630 0.31492 0.73249 1.00000
Y1 Y 0.85871 0.22231 0.06026 1.00000
Y2 Y 0.16843 0.04120 0.62195 1.00000
Y3 Y 0.83157 0.95880 0.37805 1.00000
Y4 Y 0.14129 0.77769 0.93974 1.00000
Ho1 Ho 0.62375 0.94975 0.80276 1.00000
Ho2 Ho 0.50000 0.50000 0.50000 1.00000
Ho3 Ho 0.21412 0.45843 0.11332 1.00000
Ho4 Ho 0.78588 0.54157 0.88668 1.00000
Ho5 Ho 0.37625 0.05025 0.19724 1.00000
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