K8AgPb2
Alexandria ALEXAlex-ID: agm005874483 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C8_259_spg8
K2Ag3 K KPb
2023-10-20 14:07:13
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005874483).
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 agm005874483
data_agm005874483
_cell_length_a 6.19388
_cell_length_b 8.38762
_cell_length_c 11.41594
_cell_angle_alpha 112.44691
_cell_angle_beta 105.74057
_cell_angle_gamma 90.00001
_cell_volume 524.00015
_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
K1 K 0.59774 0.75439 0.19547 1.00000
K2 K 0.33405 0.62573 0.66810 1.00000
K3 K 0.21169 0.12461 0.42338 1.00000
K4 K 0.01575 0.26309 0.03149 1.00000
K5 K 0.78831 0.87539 0.57662 1.00000
K6 K 0.66595 0.37427 0.33190 1.00000
K7 K 0.40226 0.24561 0.80453 1.00000
K8 K 0.98425 0.73691 0.96851 1.00000
Ag1 Ag 0.50000 0.00000 0.00000 1.00000
Pb1 Pb 0.16686 0.65251 0.33371 1.00000
Pb2 Pb 0.83314 0.34749 0.66629 1.00000
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