Sm5(Ho6Er)2
Alexandria ALEXAlex-ID: agm003372576 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C12_28_spg12
Sm3(Ho2Er)2 HoEr5 Sm2Ho7
2022-02-08 10:50:28.491042
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003372576).
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 agm003372576
data_agm003372576
_cell_length_a 9.24279
_cell_length_b 9.03236
_cell_length_c 8.58930
_cell_angle_alpha 91.81662
_cell_angle_beta 90.00000
_cell_angle_gamma 120.77370
_cell_volume 615.68479
_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 0.23059 0.46118 0.57103 1.00000
Sm2 Sm 0.29367 0.58733 0.97999 1.00000
Sm3 Sm 0.00000 0.00000 0.50000 1.00000
Sm4 Sm 0.70633 0.41267 0.02001 1.00000
Sm5 Sm 0.76941 0.53882 0.42897 1.00000
Ho1 Ho 0.92600 0.85201 0.12505 1.00000
Ho2 Ho 0.03122 0.70373 0.76091 1.00000
Ho3 Ho 0.67252 0.70373 0.76091 1.00000
Ho4 Ho 0.17991 0.74131 0.33043 1.00000
Ho5 Ho 0.56140 0.74131 0.33043 1.00000
Ho6 Ho 0.44323 0.88646 0.66422 1.00000
Ho7 Ho 0.55677 0.11354 0.33578 1.00000
Ho8 Ho 0.82009 0.25869 0.66957 1.00000
Ho9 Ho 0.43860 0.25869 0.66957 1.00000
Ho10 Ho 0.96878 0.29627 0.23909 1.00000
Ho11 Ho 0.32748 0.29627 0.23909 1.00000
Ho12 Ho 0.07400 0.14799 0.87495 1.00000
Er1 Er 0.67294 1.00000 0.00000 1.00000
Er2 Er 0.32706 0.00000 1.00000 1.00000
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