Y4Er
Alexandria ALEXAlex-ID: agm017807479 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4_52_spg2
YEr5 Y5Er
2025-03-24 13:10:09
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017807479).
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 agm017807479
data_agm017807479
_cell_length_a 6.29316
_cell_length_b 6.71590
_cell_length_c 9.61993
_cell_angle_alpha 95.88657
_cell_angle_beta 109.10445
_cell_angle_gamma 117.89602
_cell_volume 323.23704
_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 0.11819 0.75220 0.65109 1.00000
Y2 Y 0.88181 0.24780 0.34891 1.00000
Y3 Y 0.08441 0.25216 0.75153 1.00000
Y4 Y 0.51600 0.74960 0.44947 1.00000
Y5 Y 0.28339 0.24994 0.14869 1.00000
Y6 Y 0.71661 0.75006 0.85131 1.00000
Y7 Y 0.91559 0.74784 0.24847 1.00000
Y8 Y 0.48400 0.25040 0.55053 1.00000
Er1 Er 0.68481 0.24958 0.95064 1.00000
Er2 Er 0.31519 0.75042 0.04936 1.00000
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