Sr5(CePr2)2
Alexandria ALEXAlex-ID: agm011908404 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B4C5_290_spg12
Sr Ce Pr
2024-06-02 06:06:44.799173
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm011908404).
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 agm011908404
data_agm011908404
_cell_length_a 13.48336
_cell_length_b 13.48336
_cell_length_c 10.23268
_cell_angle_alpha 60.72015
_cell_angle_beta 60.72015
_cell_angle_gamma 16.64968
_cell_volume 463.35039
_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
Sr1 Sr 0.13511 0.13511 0.47226 1.00000
Sr2 Sr 0.86489 0.86489 0.52774 1.00000
Sr3 Sr 0.20538 0.20538 0.73573 1.00000
Sr4 Sr 0.50000 0.50000 0.50000 1.00000
Sr5 Sr 0.79462 0.79462 0.26427 1.00000
Ce1 Ce 0.54723 0.54723 0.86038 1.00000
Ce2 Ce 0.45277 0.45277 0.13962 1.00000
Pr1 Pr 0.68606 0.68606 0.10372 1.00000
Pr2 Pr 0.07181 0.07181 0.11199 1.00000
Pr3 Pr 0.31394 0.31394 0.89628 1.00000
Pr4 Pr 0.92819 0.92819 0.88801 1.00000
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