HoTm5Cd6
Alexandria ALEXAlex-ID: agm006088022 · Space group: Cmmm (#65)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C6_47_spg65
HoTmCd2 TmCd
2023-09-16 08:09:25.449300
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006088022).
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 agm006088022
data_agm006088022
_cell_length_a 5.22258
_cell_length_b 7.40769
_cell_length_c 8.27360
_cell_angle_alpha 90.00105
_cell_angle_beta 71.80271
_cell_angle_gamma 90.00306
_cell_volume 304.07429
_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
Tm1 Tm 0.66599 0.50000 0.66797 1.00000
Tm2 Tm 0.33270 1.00000 0.33453 1.00000
Tm3 Tm 0.00000 0.50000 0.00000 1.00000
Tm4 Tm 0.66730 0.00000 0.66547 1.00000
Tm5 Tm 0.33401 0.50000 0.33203 1.00000
Ho1 Ho 0.00000 0.00000 0.00000 1.00000
Cd1 Cd 0.83287 0.74846 0.33430 1.00000
Cd2 Cd 0.83287 0.25154 0.33430 1.00000
Cd3 Cd 0.50000 0.25081 0.00000 1.00000
Cd4 Cd 0.50000 0.74919 1.00000 1.00000
Cd5 Cd 0.16713 0.74846 0.66570 1.00000
Cd6 Cd 0.16713 0.25154 0.66570 1.00000
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