Sb4Pd7Pb3
Alexandria ALEXAlex-ID: agm009804325 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C7_69_spg12
Sb8Pd11 PdPb2
2024-03-07 13:11:15.386437
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009804325).
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 agm009804325
data_agm009804325
_cell_length_a 8.84465
_cell_length_b 8.84465
_cell_length_c 10.65009
_cell_angle_alpha 47.44583
_cell_angle_beta 47.44583
_cell_angle_gamma 30.05395
_cell_volume 297.87817
_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
Sb1 Sb 0.66976 0.66976 0.16995 1.00000
Sb2 Sb 0.33024 0.33024 0.83005 1.00000
Sb3 Sb 0.86882 0.86882 0.36743 1.00000
Sb4 Sb 0.13118 0.13118 0.63257 1.00000
Pd1 Pd 0.31657 0.31657 0.58973 1.00000
Pd2 Pd 0.51560 0.51560 0.78957 1.00000
Pd3 Pd 0.88966 0.88966 0.87833 1.00000
Pd4 Pd 0.68343 0.68343 0.41027 1.00000
Pd5 Pd 0.11034 0.11034 0.12167 1.00000
Pd6 Pd 0.00000 0.00000 0.00000 1.00000
Pd7 Pd 0.48440 0.48440 0.21043 1.00000
Pb1 Pb 0.33479 0.33479 0.16235 1.00000
Pb2 Pb 0.66521 0.66521 0.83765 1.00000
Pb3 Pb 0.00000 0.00000 0.50000 1.00000
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