AcLa6Ho5
Alexandria ALEXAlex-ID: agm006117927 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C6_48_spg12
La7Ho LaHo2 Ac
2023-08-30 01:32:33.365020
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006117927).
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 agm006117927
data_agm006117927
_cell_length_a 6.37752
_cell_length_b 9.69017
_cell_length_c 9.69017
_cell_angle_alpha 69.61238
_cell_angle_beta 123.17550
_cell_angle_gamma 123.17548
_cell_volume 418.50615
_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
Ac1 Ac 0.00000 0.00000 0.00000 1.00000
Ho1 Ho 0.50000 0.17123 0.82877 1.00000
Ho2 Ho 1.00000 0.33681 0.66319 1.00000
Ho3 Ho 0.50000 0.50000 0.50000 1.00000
Ho4 Ho 0.00000 0.66319 0.33681 1.00000
Ho5 Ho 0.50000 0.82877 0.17123 1.00000
La1 La 0.25685 0.08587 0.42168 1.00000
La2 La 0.74315 0.57832 0.91413 1.00000
La3 La 0.76139 0.25279 0.25279 1.00000
La4 La 0.23861 0.74721 0.74721 1.00000
La5 La 0.25685 0.42168 0.08587 1.00000
La6 La 0.74315 0.91413 0.57832 1.00000
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