SrPrSn
Alexandria ALEXAlex-ID: agm003609136 · Space group: Pmmn (#59)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC_17_spg129
Pr5Sn3 Sr2Sn Pr
2022-03-02 15:39:01.562219
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003609136).
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 agm003609136
data_agm003609136
_cell_length_a 4.88434
_cell_length_b 4.97970
_cell_length_c 8.91914
_cell_angle_alpha 90.02172
_cell_angle_beta 90.00768
_cell_angle_gamma 90.00121
_cell_volume 216.93616
_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 0.81343 0.86620 0.56051 1.00000
Sr2 Sr 0.31374 0.36674 0.27869 1.00000
Pr1 Pr 0.81359 0.36658 0.94513 1.00000
Pr2 Pr 0.31359 0.86636 0.89412 1.00000
Sn1 Sn 0.81375 0.86680 0.17362 1.00000
Sn2 Sn 0.31342 0.36614 0.66555 1.00000
