Sr3(ThPb)2
Alexandria ALEXAlex-ID: agm008954615 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_874_spg2
Sr2Pb Th5Pb4 Th
2024-06-01 19:56:17.504135
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm008954615).
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 agm008954615
data_agm008954615
_cell_length_a 12.32269
_cell_length_b 12.32269
_cell_length_c 12.32269
_cell_angle_alpha 157.56559
_cell_angle_beta 157.53842
_cell_angle_gamma 31.95620
_cell_volume 272.61735
_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 0.50000 0.00000 0.50000 1.00000
Sr2 Sr 0.11166 0.61166 0.50000 1.00000
Sr3 Sr 0.88834 0.38834 0.50000 1.00000
Th1 Th 0.24966 0.24966 0.00000 1.00000
Th2 Th 0.75034 0.75034 0.00000 1.00000
Pb1 Pb 0.64711 0.14711 0.50000 1.00000
Pb2 Pb 0.35289 0.85289 0.50000 1.00000
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