Y4In
Alexandria ALEXAlex-ID: agm005545286 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4_631_spg12
Y2In Y
2023-05-29 04:05:31.793793
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005545286).
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 agm005545286
data_agm005545286
_cell_length_a 4.85349
_cell_length_b 6.94533
_cell_length_c 9.25282
_cell_angle_alpha 99.89239
_cell_angle_beta 105.20486
_cell_angle_gamma 90.00000
_cell_volume 296.17737
_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
Y1 Y 0.10178 0.29155 0.20357 1.00000
Y2 Y 0.89822 0.70845 0.79643 1.00000
Y3 Y 0.50000 0.00000 0.00000 1.00000
Y4 Y 0.50000 0.50000 0.00000 1.00000
Y5 Y 0.70314 0.10059 0.40627 1.00000
Y6 Y 0.29686 0.89941 0.59373 1.00000
Y7 Y 0.30660 0.40198 0.61320 1.00000
Y8 Y 0.69340 0.59802 0.38680 1.00000
In1 In 0.90437 0.20504 0.80874 1.00000
In2 In 0.09563 0.79496 0.19126 1.00000
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