Y2Er3Tl2
Alexandria ALEXAlex-ID: agm003306285 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_314_spg12
Y3Er2Tl3 Er
2022-02-04 00:53:01.963781
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003306285).
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 agm003306285
data_agm003306285
_cell_length_a 4.77184
_cell_length_b 5.94197
_cell_length_c 8.37381
_cell_angle_alpha 106.65028
_cell_angle_beta 90.00000
_cell_angle_gamma 113.67429
_cell_volume 206.53442
_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 0.88252 0.76505 0.23366 1.00000
Y2 Y 0.11748 0.23495 0.76634 1.00000
Er1 Er 0.50000 0.00000 0.00000 1.00000
Er2 Er 0.63390 0.26779 0.43892 1.00000
Er3 Er 0.36610 0.73221 0.56108 1.00000
Tl1 Tl 0.81842 0.63683 0.81419 1.00000
Tl2 Tl 0.18158 0.36317 0.18581 1.00000
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