Y4Be5
Alexandria ALEXAlex-ID: agm005502894 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A4B5_4_spg139
YBe13 Y
2023-03-19 11:58:25.536009
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005502894).
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 agm005502894
data_agm005502894
_cell_length_a 7.36328
_cell_length_b 7.36328
_cell_length_c 7.36328
_cell_angle_alpha 93.89909
_cell_angle_beta 93.89909
_cell_angle_gamma 149.76883
_cell_volume 194.04929
_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 0.28312 0.00000 0.28312 1.00000
Y2 Y 0.71688 0.00000 0.71688 1.00000
Y3 Y 0.00000 0.71688 0.71688 1.00000
Y4 Y 0.00000 0.28312 0.28312 1.00000
Be1 Be 0.00000 0.00000 0.00000 1.00000
Be2 Be 0.28188 0.71812 0.00000 1.00000
Be3 Be 0.71812 0.28188 0.00000 1.00000
Be4 Be 0.71812 0.71812 0.43623 1.00000
Be5 Be 0.28188 0.28188 0.56377 1.00000
Get direct link