Ac4Pm7Pb6
Alexandria ALEXAlex-ID: agm003385877 · Space group: Im-3m (#229)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A4B6C7_1_spg229
Ac2Pm3Pb4 Pm5Pb3 Ac
2022-02-12 10:45:57.735115
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003385877).
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 agm003385877
data_agm003385877
_cell_length_a 9.13933
_cell_length_b 9.13933
_cell_length_c 9.13933
_cell_angle_alpha 109.47122
_cell_angle_beta 109.47122
_cell_angle_gamma 109.47122
_cell_volume 587.65270
_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
Ac1 Ac 0.50000 0.00000 0.00000 1.00000
Ac2 Ac 0.50000 0.50000 0.50000 1.00000
Ac3 Ac 0.00000 0.50000 0.00000 1.00000
Ac4 Ac 0.00000 0.00000 0.50000 1.00000
Pm1 Pm 0.75000 0.50000 0.25000 1.00000
Pm2 Pm 0.25000 0.75000 0.50000 1.00000
Pm3 Pm 0.50000 0.75000 0.25000 1.00000
Pm4 Pm 0.75000 0.25000 0.50000 1.00000
Pm5 Pm 0.25000 0.50000 0.75000 1.00000
Pm6 Pm 0.50000 0.25000 0.75000 1.00000
Pm7 Pm 0.00000 0.00000 0.00000 1.00000
Pb1 Pb 0.69605 0.00000 0.69605 1.00000
Pb2 Pb 0.69605 0.69605 0.00000 1.00000
Pb3 Pb 0.00000 0.30395 0.30395 1.00000
Pb4 Pb 0.30395 0.00000 0.30395 1.00000
Pb5 Pb 0.30395 0.30395 0.00000 1.00000
Pb6 Pb 0.00000 0.69605 0.69605 1.00000
Get direct link