PmSm(HoAg2)2
Alexandria ALEXAlex-ID: agm034242597 · Space group: P4/mmm (#123)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D4_471_spg47
SmHo4Ag5 PmHoAg2 PmSm2Ag3
2025-02-26 15:48:48
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm034242597).
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 agm034242597
data_agm034242597
_cell_length_a 7.33034
_cell_length_b 7.33034
_cell_length_c 7.35896
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 395.42593
_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 0.50000 0.50000 1.00000
Pm2 Pm 0.50000 0.00000 0.50000 1.00000
Sm1 Sm 0.50000 0.50000 0.50000 1.00000
Sm2 Sm 0.50000 0.50000 0.00000 1.00000
Ho1 Ho 0.50000 0.00000 0.00000 1.00000
Ho2 Ho 0.00000 0.50000 0.00000 1.00000
Ho3 Ho 0.00000 0.00000 0.00000 1.00000
Ho4 Ho 0.00000 0.00000 0.50000 1.00000
Ag1 Ag 0.24249 0.24249 0.75935 1.00000
Ag2 Ag 0.24249 0.24249 0.24065 1.00000
Ag3 Ag 0.75751 0.75751 0.75935 1.00000
Ag4 Ag 0.75751 0.75751 0.24065 1.00000
Ag5 Ag 0.24249 0.75751 0.75935 1.00000
Ag6 Ag 0.75751 0.24249 0.75935 1.00000
Ag7 Ag 0.24249 0.75751 0.24065 1.00000
Ag8 Ag 0.75751 0.24249 0.24065 1.00000
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