PmHo4Mg7
Alexandria ALEXAlex-ID: agm003668898 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C7_85_spg12
PmMg3 HoMg
2022-04-20 11:20:06.758263
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003668898).
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 agm003668898
data_agm003668898
_cell_length_a 5.65861
_cell_length_b 10.72985
_cell_length_c 6.45876
_cell_angle_alpha 86.94692
_cell_angle_beta 64.02000
_cell_angle_gamma 74.71113
_cell_volume 339.16880
_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 0.00000 0.00000 0.00000 1.00000
Ho1 Ho 0.61226 0.22251 0.55297 1.00000
Ho2 Ho 0.38774 0.77749 0.44703 1.00000
Ho3 Ho 0.75007 0.67827 0.82159 1.00000
Ho4 Ho 0.24993 0.32173 0.17841 1.00000
Mg1 Mg 0.77856 0.92183 0.52105 1.00000
Mg2 Mg 0.22144 0.07817 0.47895 1.00000
Mg3 Mg 0.06549 0.67320 0.19582 1.00000
Mg4 Mg 0.93451 0.32680 0.80418 1.00000
Mg5 Mg 0.36633 0.51008 0.75726 1.00000
Mg6 Mg 0.50000 0.00000 0.00000 1.00000
Mg7 Mg 0.63367 0.48992 0.24274 1.00000
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