Sr3(CrPb)4
Alexandria ALEXAlex-ID: agm002265636 · Space group: I-43m (#217)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C4_2_spg217
SrPb3 Cr SrPb
2018-10-23 13:08:11
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002265636).
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
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# CIF generated by HEAS from Alexandria entry agm002265636
data_agm002265636
_cell_length_a 7.19526
_cell_length_b 7.19526
_cell_length_c 7.19526
_cell_angle_alpha 109.47122
_cell_angle_beta 109.47122
_cell_angle_gamma 109.47122
_cell_volume 286.75923
_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
Pb1 Pb 0.00000 0.00000 0.41771 1.00000
Pb2 Pb 0.58229 0.58229 0.58229 1.00000
Pb3 Pb 1.00000 0.41771 1.00000 1.00000
Pb4 Pb 0.41771 0.00000 0.00000 1.00000
Sr1 Sr 0.00000 0.50000 0.50000 1.00000
Sr2 Sr 0.50000 0.00000 0.50000 1.00000
Sr3 Sr 0.50000 0.50000 0.00000 1.00000
Cr1 Cr 1.00000 0.80652 1.00000 1.00000
Cr2 Cr 0.19348 0.19348 0.19348 1.00000
Cr3 Cr 0.80652 0.00000 0.00000 1.00000
Cr4 Cr 0.00000 0.00000 0.80652 1.00000
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