Sr3(ZnCu)4
Alexandria ALEXAlex-ID: agm005708322 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C4_0_spg71
SrZn2 SrZnCu2
2023-07-02 00:46:38.773093
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005708322).
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 agm005708322
data_agm005708322
_cell_length_a 4.35023
_cell_length_b 4.49066
_cell_length_c 12.86237
_cell_angle_alpha 81.18356
_cell_angle_beta 80.33999
_cell_angle_gamma 90.12931
_cell_volume 244.68124
_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
Sr1 Sr 0.65108 0.13729 0.69798 1.00000
Sr2 Sr 0.34889 0.86274 0.30202 1.00000
Sr3 Sr 0.99999 0.00002 1.00000 1.00000
Zn1 Zn 0.55316 0.54920 0.89521 1.00000
Zn2 Zn 0.44681 0.45083 0.10479 1.00000
Zn3 Zn 0.79419 0.34429 0.40876 1.00000
Zn4 Zn 0.20579 0.65573 0.59124 1.00000
Cu1 Cu 0.10360 0.58893 0.79482 1.00000
Cu2 Cu 0.24676 0.18799 0.50298 1.00000
Cu3 Cu 0.75321 0.81203 0.49702 1.00000
Cu4 Cu 0.89637 0.41109 0.20518 1.00000
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