Sm4YRh2
Alexandria ALEXAlex-ID: agm017806656 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_452_spg5
Y7Rh3 Sm3Rh Sm5Rh2
2025-05-18 04:15:59
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017806656).
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 agm017806656
data_agm017806656
_cell_length_a 6.42928
_cell_length_b 6.42928
_cell_length_c 9.10174
_cell_angle_alpha 65.58031
_cell_angle_beta 114.41969
_cell_angle_gamma 145.42360
_cell_volume 192.45891
_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 0.88601 0.11399 0.07397 1.00000
Sm2 Sm 0.11431 0.88569 0.92602 1.00000
Sm3 Sm 0.66849 0.33151 0.31049 1.00000
Sm4 Sm 0.33195 0.66805 0.68954 1.00000
Y1 Y 0.00022 0.99978 0.49998 1.00000
Rh1 Rh 0.32317 0.67683 0.25897 1.00000
Rh2 Rh 0.67720 0.32280 0.74103 1.00000
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