YErB8
Alexandria ALEXAlex-ID: agm024397467 · Space group: Cmmm (#65)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC8_15_spg65
ErB4 YB4
2024-08-25 12:08:19.130438
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024397467).
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 agm024397467
data_agm024397467
_cell_length_a 7.09345
_cell_length_b 7.09345
_cell_length_c 4.00983
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 90.26890
_cell_volume 201.76024
_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 0.68173 0.68173 0.50000 1.00000
Y2 Y 0.31827 0.31827 0.50000 1.00000
Er1 Er 0.81878 0.18122 0.50000 1.00000
Er2 Er 0.18122 0.81878 0.50000 1.00000
B1 B 0.50000 0.00000 0.29673 1.00000
B2 B 0.00000 0.50000 0.29673 1.00000
B3 B 0.50000 0.00000 0.70327 1.00000
B4 B 0.00000 0.50000 0.70327 1.00000
B5 B 0.46044 0.82367 0.00000 1.00000
B6 B 0.53956 0.17633 0.00000 1.00000
B7 B 0.03802 0.32355 0.00000 1.00000
B8 B 0.96198 0.67645 0.00000 1.00000
B9 B 0.32355 0.03802 0.00000 1.00000
B10 B 0.67645 0.96198 0.00000 1.00000
B11 B 0.82367 0.46044 0.00000 1.00000
B12 B 0.17633 0.53956 0.00000 1.00000
B13 B 0.91307 0.91307 0.00000 1.00000
B14 B 0.08693 0.08693 0.00000 1.00000
B15 B 0.58681 0.41319 0.00000 1.00000
B16 B 0.41319 0.58681 0.00000 1.00000
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