Ac6HoEr2
Alexandria ALEXAlex-ID: agm005771747 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_1438_spg15
Ho7Er2 HoEr5 Ac
2023-07-07 23:26:05.892470
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005771747).
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 agm005771747
data_agm005771747
_cell_length_a 6.68424
_cell_length_b 12.22323
_cell_length_c 12.22323
_cell_angle_alpha 63.55740
_cell_angle_beta 60.77904
_cell_angle_gamma 60.77904
_cell_volume 732.04644
_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 0.71848 0.68536 0.53007 1.00000
Ac2 Ac 0.78152 0.46993 0.31464 1.00000
Ac3 Ac 0.28152 0.31464 0.46993 1.00000
Ac4 Ac 0.21848 0.53007 0.68536 1.00000
Ac5 Ac 0.72795 0.03719 0.30445 1.00000
Ac6 Ac 0.77205 0.69555 0.96281 1.00000
Ac7 Ac 0.27205 0.96281 0.69555 1.00000
Ac8 Ac 0.22795 0.30445 0.03719 1.00000
Ac9 Ac 0.13925 0.69423 0.17974 1.00000
Ac10 Ac 0.36075 0.82026 0.30577 1.00000
Ac11 Ac 0.86075 0.30577 0.82026 1.00000
Ac12 Ac 0.63925 0.17974 0.69423 1.00000
Ho1 Ho 0.25000 0.01069 0.98931 1.00000
Ho2 Ho 0.75000 0.98931 0.01069 1.00000
Er1 Er 0.42143 0.61547 0.87257 1.00000
Er2 Er 0.07857 0.12743 0.38453 1.00000
Er3 Er 0.57857 0.38453 0.12743 1.00000
Er4 Er 0.92143 0.87257 0.61547 1.00000
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