HoCrB14
Alexandria ALEXAlex-ID: agm005755660 · Space group: Imma (#74)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC14_1_spg74
HoB12 CrB4 HoB4
2023-07-18 13:57:17.417210
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005755660).
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 agm005755660
data_agm005755660
_cell_length_a 5.84778
_cell_length_b 7.33450
_cell_length_c 7.33449
_cell_angle_alpha 67.86188
_cell_angle_beta 66.50624
_cell_angle_gamma 66.50624
_cell_volume 255.55166
_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
Ho1 Ho 0.25000 0.37823 0.12177 1.00000
Ho2 Ho 0.75000 0.62177 0.87823 1.00000
Cr1 Cr 0.50000 0.00000 0.50000 1.00000
Cr2 Cr 0.00000 0.00000 0.50000 1.00000
B1 B 0.66736 0.36386 0.30143 1.00000
B2 B 0.33264 0.63614 0.69857 1.00000
B3 B 0.16736 0.80143 0.86386 1.00000
B4 B 0.83264 0.19857 0.13614 1.00000
B5 B 0.12913 0.24096 0.50077 1.00000
B6 B 0.87087 0.75904 0.49923 1.00000
B7 B 0.62913 0.00077 0.74096 1.00000
B8 B 0.37087 0.99923 0.25904 1.00000
B9 B 0.08415 0.08690 0.74481 1.00000
B10 B 0.91585 0.91310 0.25519 1.00000
B11 B 0.58415 0.24481 0.58690 1.00000
B12 B 0.41585 0.75519 0.41310 1.00000
B13 B 0.72353 0.59808 0.27472 1.00000
B14 B 0.59634 0.40191 0.72528 1.00000
B15 B 0.22353 0.77472 0.09809 1.00000
B16 B 0.09634 0.22528 0.90191 1.00000
B17 B 0.27647 0.40192 0.72528 1.00000
B18 B 0.40366 0.59808 0.27472 1.00000
B19 B 0.77647 0.22528 0.90192 1.00000
B20 B 0.90366 0.77472 0.09809 1.00000
B21 B 0.32668 0.96958 0.87325 1.00000
B22 B 0.16950 0.03042 0.12675 1.00000
B23 B 0.82668 0.37325 0.46958 1.00000
B24 B 0.66950 0.62675 0.53042 1.00000
B25 B 0.67332 0.03042 0.12675 1.00000
B26 B 0.83050 0.96958 0.87325 1.00000
B27 B 0.17332 0.62675 0.53042 1.00000
B28 B 0.33050 0.37325 0.46958 1.00000
