Sm4Y7Ho
Alexandria ALEXAlex-ID: agm003665415 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C7_85_spg12
Sm3(Y2Ho)2 SmY2
2022-04-20 19:03:53.302264
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003665415).
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 agm003665415
data_agm003665415
_cell_length_a 5.90623
_cell_length_b 11.74317
_cell_length_c 6.75503
_cell_angle_alpha 83.37989
_cell_angle_beta 64.07638
_cell_angle_gamma 75.43519
_cell_volume 407.82244
_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 0.64278 0.22340 0.49105 1.00000
Sm2 Sm 0.35722 0.77660 0.50895 1.00000
Sm3 Sm 0.78065 0.66507 0.77362 1.00000
Sm4 Sm 0.21935 0.33493 0.22638 1.00000
Y1 Y 0.78878 0.92330 0.49913 1.00000
Y2 Y 0.21122 0.07670 0.50087 1.00000
Y3 Y 0.07017 0.69197 0.16769 1.00000
Y4 Y 0.92983 0.30803 0.83231 1.00000
Y5 Y 0.36783 0.49416 0.77019 1.00000
Y6 Y 0.50000 0.00000 0.00000 1.00000
Y7 Y 0.63217 0.50584 0.22981 1.00000
Ho1 Ho 0.00000 0.00000 0.00000 1.00000
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