Pm3Ho5Sn2
Alexandria ALEXAlex-ID: agm003344296 · Space group: Ibam (#72)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C5_101_spg72
Pm2Ho7 Ho5Sn3 Pm3Ho2Sn3
2022-02-02 13:56:22.503753
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003344296).
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 agm003344296
data_agm003344296
_cell_length_a 6.38918
_cell_length_b 10.58560
_cell_length_c 10.58560
_cell_angle_alpha 94.99071
_cell_angle_beta 72.43511
_cell_angle_gamma 72.43507
_cell_volume 638.12418
_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 0.25000 0.00000 0.00000 1.00000
Pm2 Pm 0.75000 0.00000 0.00000 1.00000
Pm3 Pm 0.37390 0.34863 0.90358 1.00000
Pm4 Pm 0.62610 0.65137 0.09642 1.00000
Pm5 Pm 0.87390 0.90358 0.34863 1.00000
Pm6 Pm 0.12610 0.09642 0.65137 1.00000
Ho1 Ho 0.25000 0.50000 0.50000 1.00000
Ho2 Ho 0.75000 0.50000 0.50000 1.00000
Ho3 Ho 0.50303 0.74697 0.74697 1.00000
Ho4 Ho 0.99697 0.25303 0.25303 1.00000
Ho5 Ho 0.49697 0.25303 0.25303 1.00000
Ho6 Ho 0.00303 0.74697 0.74697 1.00000
Ho7 Ho 0.10112 0.56315 0.23461 1.00000
Ho8 Ho 0.89888 0.43685 0.76539 1.00000
Ho9 Ho 0.60112 0.23461 0.56315 1.00000
Ho10 Ho 0.39888 0.76539 0.43685 1.00000
Sn1 Sn 0.14136 0.71080 0.00648 1.00000
Sn2 Sn 0.85864 0.28920 0.99352 1.00000
Sn3 Sn 0.64136 0.00648 0.71080 1.00000
Sn4 Sn 0.35864 0.99352 0.28920 1.00000
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