AcZnSn2
Alexandria ALEXAlex-ID: agm005752087 · Space group: Cmcm (#63)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2_931_spg63
Ac2Zn2Sn3 AcZn13 AcSn3
2023-07-13 18:40:51.527422
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005752087).
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 agm005752087
data_agm005752087
_cell_length_a 5.17796
_cell_length_b 4.66063
_cell_length_c 9.63058
_cell_angle_alpha 104.00286
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 225.50435
_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
Ac1 Ac 0.25000 0.89534 0.79068 1.00000
Ac2 Ac 0.75000 0.10466 0.20932 1.00000
Zn1 Zn 0.75000 0.32379 0.64758 1.00000
Zn2 Zn 0.25000 0.67621 0.35242 1.00000
Sn1 Sn 0.25000 0.25323 0.50646 1.00000
Sn2 Sn 0.75000 0.74677 0.49354 1.00000
Sn3 Sn 0.75000 0.46492 0.92984 1.00000
Sn4 Sn 0.25000 0.53508 0.07016 1.00000
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