LaZn11Pt
Alexandria ALEXAlex-ID: agm005693590 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC11_5_spg12
LaZn9Pt2 Zn11Pt2 La2Zn17
2023-06-29 15:46:08.181329
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005693590).
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 agm005693590
data_agm005693590
_cell_length_a 5.21152
_cell_length_b 6.93369
_cell_length_c 6.93125
_cell_angle_alpha 81.73316
_cell_angle_beta 67.91736
_cell_angle_gamma 67.51385
_cell_volume 214.44266
_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
La1 La 0.00000 0.00000 0.00000 1.00000
Zn1 Zn 0.27436 0.22249 0.22537 1.00000
Zn2 Zn 0.72564 0.77751 0.77463 1.00000
Zn3 Zn 0.50027 0.77751 0.22537 1.00000
Zn4 Zn 0.49973 0.22249 0.77463 1.00000
Zn5 Zn 0.36829 0.64254 0.64593 1.00000
Zn6 Zn 0.63171 0.35746 0.35407 1.00000
Zn7 Zn 0.98578 0.35746 0.64593 1.00000
Zn8 Zn 0.01422 0.64254 0.35407 1.00000
Zn9 Zn 0.00000 0.50000 0.00000 1.00000
Zn10 Zn 0.50000 0.00000 0.50000 1.00000
Zn11 Zn 0.00000 0.00000 0.50000 1.00000
Pt1 Pt 0.50000 0.50000 0.00000 1.00000
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