Y(Ho5Sc)2
Alexandria ALEXAlex-ID: agm003385928 · Space group: Fmmm (#69)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C10_0_spg69
YHo8 Ho Sc
2022-02-12 12:14:26.441792
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003385928).
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 agm003385928
data_agm003385928
_cell_length_a 6.44298
_cell_length_b 8.23241
_cell_length_c 9.07170
_cell_angle_alpha 82.01218
_cell_angle_beta 69.19956
_cell_angle_gamma 66.96346
_cell_volume 413.94299
_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
Y1 Y 0.00000 0.00000 0.00000 1.00000
Ho1 Ho 0.34138 0.63912 0.67812 1.00000
Ho2 Ho 0.65862 0.36088 0.32188 1.00000
Ho3 Ho 0.98050 0.36088 0.67812 1.00000
Ho4 Ho 0.01950 0.63912 0.32188 1.00000
Ho5 Ho 0.00000 0.00000 0.50000 1.00000
Ho6 Ho 0.50000 0.00000 0.50000 1.00000
Ho7 Ho 0.29593 0.21063 0.19750 1.00000
Ho8 Ho 0.70407 0.78937 0.80250 1.00000
Ho9 Ho 0.50656 0.78937 0.19750 1.00000
Ho10 Ho 0.49344 0.21063 0.80250 1.00000
Sc1 Sc 0.00000 0.50000 0.00000 1.00000
Sc2 Sc 0.50000 0.50000 0.00000 1.00000
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