Pm6Ag5Pb
Alexandria ALEXAlex-ID: agm006097771 · Space group: Cmmm (#65)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C6_47_spg65
PmAg2 PmAg Pm5AgPb3
2023-08-15 17:33:11.604557
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006097771).
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 agm006097771
data_agm006097771
_cell_length_a 5.29150
_cell_length_b 7.59896
_cell_length_c 8.38921
_cell_angle_alpha 89.99995
_cell_angle_beta 108.47682
_cell_angle_gamma 90.00013
_cell_volume 319.94099
_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 0.00000 1.00000
Ag1 Ag 0.66280 0.50000 0.33231 1.00000
Ag2 Ag 0.33728 1.00000 0.66875 1.00000
Ag3 Ag 0.00000 0.50000 0.00000 1.00000
Ag4 Ag 0.66272 0.00000 0.33125 1.00000
Ag5 Ag 0.33720 0.50000 0.66769 1.00000
Pm1 Pm 0.83170 0.74618 0.66002 1.00000
Pm2 Pm 0.83169 0.25383 0.66002 1.00000
Pm3 Pm 0.50000 0.25808 1.00000 1.00000
Pm4 Pm 0.50000 0.74192 0.00000 1.00000
Pm5 Pm 0.16831 0.74617 0.33998 1.00000
Pm6 Pm 0.16830 0.25382 0.33998 1.00000
Get direct link