Y3CoB7
Alexandria ALEXAlex-ID: agm005992985 · Space group: Cmcm (#63)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C7_38_spg63
Y4CoB14 Y(CoB)2 Y5(CoB3)2
2023-08-11 13:10:28.701636
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005992985).
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 agm005992985
data_agm005992985
_cell_length_a 3.40851
_cell_length_b 8.06039
_cell_length_c 9.34130
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 102.20649
_cell_volume 250.83978
_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 0.10526 0.21052 0.43885 1.00000
Y2 Y 0.89474 0.78948 0.56115 1.00000
Y3 Y 0.24362 0.48725 0.75000 1.00000
Y4 Y 0.75638 0.51275 0.25000 1.00000
Y5 Y 0.10526 0.21052 0.06115 1.00000
Y6 Y 0.89474 0.78948 0.93885 1.00000
Co1 Co 0.94573 0.89147 0.25000 1.00000
Co2 Co 0.05427 0.10853 0.75000 1.00000
B1 B 0.46125 0.92251 0.75000 1.00000
B2 B 0.53875 0.07749 0.25000 1.00000
B3 B 0.47817 0.95634 0.40225 1.00000
B4 B 0.52183 0.04366 0.59775 1.00000
B5 B 0.52183 0.04366 0.90225 1.00000
B6 B 0.47817 0.95634 0.09775 1.00000
B7 B 0.36990 0.73979 0.34701 1.00000
B8 B 0.63010 0.26021 0.65299 1.00000
B9 B 0.27233 0.54467 0.46725 1.00000
B10 B 0.72767 0.45533 0.53275 1.00000
B11 B 0.72767 0.45533 0.96725 1.00000
B12 B 0.27233 0.54467 0.03275 1.00000
B13 B 0.36990 0.73979 0.15299 1.00000
B14 B 0.63010 0.26021 0.84701 1.00000
