SmHoZn4
Alexandria ALEXAlex-ID: agm003751658 · Space group: P4/mmm (#123)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC4_1114_spg123
SmZn2 HoZn2
2022-04-19 10:50:32.474608
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003751658).
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 agm003751658
data_agm003751658
_cell_length_a 3.77175
_cell_length_b 3.77803
_cell_length_c 9.82704
_cell_angle_alpha 89.59405
_cell_angle_beta 89.87909
_cell_angle_gamma 90.03933
_cell_volume 140.02942
_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 0.50162 0.49689 0.99816 1.00000
Ho1 Ho 0.00116 0.99742 0.49816 1.00000
Zn1 Zn 0.50158 0.99638 0.25283 1.00000
Zn2 Zn 0.50080 0.99819 0.74342 1.00000
Zn3 Zn 0.00162 0.49604 0.74325 1.00000
Zn4 Zn 0.00100 0.49880 0.25301 1.00000
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