DyCd2BiO6
Alexandria ALEXAlex-ID: agm004948880 · Space group: R3 (#146)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D6_266_spg146
Dy3BiO7 Cd4Bi2O9 Cd7(BiO6)2
2022-07-29 10:52:55.000996
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004948880).
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
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# CIF generated by HEAS from Alexandria entry agm004948880
data_agm004948880
_cell_length_a 5.76031
_cell_length_b 5.76046
_cell_length_c 6.04352
_cell_angle_alpha 61.53918
_cell_angle_beta 61.53823
_cell_angle_gamma 59.99888
_cell_volume 145.00807
_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
Dy1 Dy 0.81185 0.81186 0.56442 1.00000
Cd1 Cd 0.53532 0.53532 0.39402 1.00000
Cd2 Cd 0.03151 0.03152 0.90550 1.00000
Bi1 Bi 0.31731 0.31732 0.04806 1.00000
O1 O 0.58865 0.19822 0.26134 1.00000
O2 O 0.19820 0.95180 0.26131 1.00000
O3 O 0.95178 0.58866 0.26135 1.00000
O4 O 0.43181 0.68666 0.77307 1.00000
O5 O 0.68668 0.10844 0.77308 1.00000
O6 O 0.10849 0.43182 0.77304 1.00000
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