Y5Ho4Tm
Alexandria ALEXAlex-ID: agm003640862 · Space group: I4 (#79)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C5_149_spg79
HoTm2 Ho7Tm2 Y5Ho
2022-04-08 07:29:13.171322
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003640862).
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 agm003640862
data_agm003640862
_cell_length_a 6.26644
_cell_length_b 7.85923
_cell_length_c 7.85923
_cell_angle_alpha 80.85488
_cell_angle_beta 66.50511
_cell_angle_gamma 66.50511
_cell_volume 325.54455
_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 0.80635 0.37935 0.91405 1.00000
Y2 Y 0.18570 0.91405 0.62065 1.00000
Y3 Y 0.72040 0.08595 0.37935 1.00000
Y4 Y 0.09976 0.62065 0.08595 1.00000
Y5 Y 0.67811 1.00000 1.00000 1.00000
Ho1 Ho 0.40251 0.39609 0.69988 1.00000
Ho2 Ho 0.79860 0.69988 0.60391 1.00000
Ho3 Ho 0.10238 0.30012 0.39609 1.00000
Ho4 Ho 0.49847 0.60391 0.30012 1.00000
Tm1 Tm 0.21802 1.00000 1.00000 1.00000
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