Na4Sr5Cd2
Alexandria ALEXAlex-ID: agm005672170 · Space group: Pbam (#55)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B4C5_653_spg55
Sr2Cd Na Sr
2023-06-22 06:37:51.449061
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005672170).
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 agm005672170
data_agm005672170
_cell_length_a 4.27258
_cell_length_b 9.80498
_cell_length_c 21.55855
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 903.14238
_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
Na1 Na 0.50000 0.29552 0.56728 1.00000
Na2 Na 0.50000 0.70448 0.43272 1.00000
Na3 Na 0.50000 0.79552 0.93272 1.00000
Na4 Na 0.50000 0.20448 0.06728 1.00000
Na5 Na 0.50000 0.42103 0.84788 1.00000
Na6 Na 0.50000 0.57897 0.15212 1.00000
Na7 Na 0.50000 0.92103 0.65212 1.00000
Na8 Na 0.50000 0.07897 0.34788 1.00000
Sr1 Sr 0.00000 0.50000 0.00000 1.00000
Sr2 Sr 0.00000 0.00000 0.50000 1.00000
Sr3 Sr 0.00000 0.26083 0.21784 1.00000
Sr4 Sr 0.00000 0.73917 0.78216 1.00000
Sr5 Sr 0.00000 0.76083 0.28216 1.00000
Sr6 Sr 0.00000 0.23917 0.71784 1.00000
Sr7 Sr 0.00000 0.38418 0.41328 1.00000
Sr8 Sr 0.00000 0.61582 0.58672 1.00000
Sr9 Sr 0.00000 0.88418 0.08672 1.00000
Sr10 Sr 0.00000 0.11582 0.91328 1.00000
Cd1 Cd 0.50000 0.48049 0.29874 1.00000
Cd2 Cd 0.50000 0.51951 0.70126 1.00000
Cd3 Cd 0.50000 0.98049 0.20126 1.00000
Cd4 Cd 0.50000 0.01951 0.79874 1.00000
