Er3(In2Au)2
Alexandria ALEXAlex-ID: agm005674197 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_272_spg12
Er3In7 Er5(In2Au)2 ErInAu
2023-06-27 05:53:48.965404
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005674197).
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 agm005674197
data_agm005674197
_cell_length_a 4.79730
_cell_length_b 6.02463
_cell_length_c 8.55842
_cell_angle_alpha 74.46269
_cell_angle_beta 73.72382
_cell_angle_gamma 66.53803
_cell_volume 214.35309
_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
Er1 Er 0.32511 0.69871 0.65108 1.00000
Er2 Er 0.00000 0.00000 0.00000 1.00000
Er3 Er 0.67489 0.30129 0.34892 1.00000
In1 In 0.26562 0.39271 0.07605 1.00000
In2 In 0.73438 0.60729 0.92395 1.00000
In3 In 0.03231 0.30009 0.63529 1.00000
In4 In 0.96769 0.69991 0.36471 1.00000
Au1 Au 0.39610 0.93351 0.27429 1.00000
Au2 Au 0.60390 0.06649 0.72571 1.00000
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