Ac(Zn3Ag)3
Alexandria ALEXAlex-ID: agm006018367 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C9_320_spg12
ZnAg2 Ac2Zn15Ag2 AcZn13
2023-08-10 09:04:32.726944
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006018367).
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 agm006018367
data_agm006018367
_cell_length_a 5.28546
_cell_length_b 7.22603
_cell_length_c 7.16685
_cell_angle_alpha 81.64885
_cell_angle_beta 68.36184
_cell_angle_gamma 66.80408
_cell_volume 233.86620
_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 0.00000 0.00000 0.00000 1.00000
Zn1 Zn 0.74025 0.76720 0.77179 1.00000
Zn2 Zn 0.25975 0.23280 0.22821 1.00000
Zn3 Zn 0.48795 0.23280 0.77179 1.00000
Zn4 Zn 0.51205 0.76720 0.22821 1.00000
Zn5 Zn 0.63627 0.35978 0.35956 1.00000
Zn6 Zn 0.36373 0.64022 0.64044 1.00000
Zn7 Zn 0.00417 0.64022 0.35956 1.00000
Zn8 Zn 0.99583 0.35978 0.64044 1.00000
Zn9 Zn 0.00000 0.50000 0.00000 1.00000
Ag1 Ag 0.50000 0.50000 0.00000 1.00000
Ag2 Ag 0.00000 0.00000 0.50000 1.00000
Ag3 Ag 0.50000 0.00000 0.50000 1.00000
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