PrSm2(Ho2Tm)2
Alexandria ALEXAlex-ID: agm027770495 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D4_0_spg12
HoTm5 PrSm4 Sm2Ho7 PrSmHo4
2025-01-06 22:08:01
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm027770495).
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 agm027770495
data_agm027770495
_cell_length_a 9.49498
_cell_length_b 9.49498
_cell_length_c 9.53319
_cell_angle_alpha 64.76140
_cell_angle_beta 115.23860
_cell_angle_gamma 158.23079
_cell_volume 287.13263
_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
Pr1 Pr 0.00000 0.00000 0.00000 1.00000
Sm1 Sm 0.33258 0.66742 0.00038 1.00000
Sm2 Sm 0.66742 0.33258 0.99962 1.00000
Ho1 Ho 0.81381 0.18619 0.66333 1.00000
Ho2 Ho 0.18619 0.81381 0.33667 1.00000
Ho3 Ho 0.51927 0.48073 0.33810 1.00000
Ho4 Ho 0.48073 0.51927 0.66190 1.00000
Tm1 Tm 0.85233 0.14767 0.33606 1.00000
Tm2 Tm 0.14767 0.85233 0.66394 1.00000
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