Pm6Ho3Er2Mg
Alexandria ALEXAlex-ID: agm004651981 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6_178_spg12
Pm3Ho5 PmEr2 PmMg Pm
2022-06-27 21:44:29.799373
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004651981).
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 agm004651981
data_agm004651981
_cell_length_a 6.19644
_cell_length_b 6.19644
_cell_length_c 11.70782
_cell_angle_alpha 95.07375
_cell_angle_beta 95.07375
_cell_angle_gamma 120.02225
_cell_volume 383.07772
_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
Pm1 Pm 0.91779 0.58489 0.75186 1.00000
Pm2 Pm 0.74929 0.74929 0.24923 1.00000
Pm3 Pm 0.08221 0.41511 0.24814 1.00000
Pm4 Pm 0.58489 0.91779 0.75186 1.00000
Pm5 Pm 0.25071 0.25071 0.75077 1.00000
Pm6 Pm 0.41511 0.08221 0.24814 1.00000
Ho1 Ho 0.16647 0.83353 0.50000 1.00000
Ho2 Ho 0.83353 0.16647 0.50000 1.00000
Ho3 Ho 0.50000 0.50000 0.50000 1.00000
Er1 Er 0.33348 0.66652 0.00000 1.00000
Er2 Er 0.66652 0.33348 0.00000 1.00000
Mg1 Mg 0.00000 0.00000 0.00000 1.00000
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