K2Sr6La3Bi5O24
Alexandria ALEXAlex-ID: agm010609237 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C5D6E24_6_spg65
KBiO3 Sr2LaBiO6
2025-02-20 20:07:43
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010609237).
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 agm010609237
data_agm010609237
_cell_length_a 6.15487
_cell_length_b 8.66581
_cell_length_c 12.97130
_cell_angle_alpha 109.72159
_cell_angle_beta 89.76379
_cell_angle_gamma 90.48300
_cell_volume 651.24404
_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 0.51421 0.50688 0.50685 1.00000
K2 K 0.49245 0.99385 0.49261 1.00000
Sr1 Sr 0.00355 0.38700 0.27748 1.00000
Sr2 Sr 0.99209 0.87641 0.24652 1.00000
Sr3 Sr 0.50564 0.73669 0.98140 1.00000
Sr4 Sr 0.01429 0.61957 0.73183 1.00000
Sr5 Sr 0.48878 0.25978 0.00730 1.00000
Sr6 Sr 0.96594 0.12690 0.74542 1.00000
La1 La 0.99624 0.99953 0.00169 1.00000
La2 La 0.49345 0.62366 0.25046 1.00000
La3 La 0.49974 0.37080 0.74605 1.00000
Bi1 Bi 0.99947 0.50085 0.99984 1.00000
Bi2 Bi 0.50455 0.87863 0.75354 1.00000
Bi3 Bi 0.00499 0.75658 0.50089 1.00000
Bi4 Bi 0.00036 0.24242 0.49712 1.00000
Bi5 Bi 0.49278 0.12507 0.24820 1.00000
O1 O 0.59437 0.34613 0.22606 1.00000
O2 O 0.70755 0.58324 0.09273 1.00000
O3 O 0.18192 0.50024 0.14079 1.00000
O4 O 0.81800 0.49397 0.85612 1.00000
O5 O 0.29513 0.43232 0.90815 1.00000
O6 O 0.41251 0.89926 0.26725 1.00000
O7 O 0.10003 0.75220 0.03543 1.00000
O8 O 0.43193 0.63351 0.73736 1.00000
O9 O 0.95801 0.51388 0.52461 1.00000
O10 O 0.69105 0.99236 0.11318 1.00000
O11 O 0.21435 0.12892 0.15358 1.00000
O12 O 0.32280 0.95951 0.90061 1.00000
O13 O 0.78648 0.86207 0.84387 1.00000
O14 O 0.73829 0.85149 0.61318 1.00000
O15 O 0.19768 0.86429 0.65634 1.00000
O16 O 0.26864 0.65640 0.40040 1.00000
O17 O 0.81021 0.68457 0.35805 1.00000
O18 O 0.91024 0.24600 0.96329 1.00000
O19 O 0.04548 0.98278 0.46405 1.00000
O20 O 0.55811 0.12694 0.77849 1.00000
O21 O 0.73152 0.26737 0.59943 1.00000
O22 O 0.18201 0.30027 0.64325 1.00000
O23 O 0.26913 0.25637 0.39108 1.00000
O24 O 0.80604 0.16127 0.34547 1.00000
