Ho2ZrScBi4
Alexandria ALEXAlex-ID: agm004841663 · Space group: P2/m (#10)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D4_343_spg10
HoBi ZrBi ScBi
2022-07-20 10:33:05.476277
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004841663).
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 agm004841663
data_agm004841663
_cell_length_a 4.34689
_cell_length_b 7.53170
_cell_length_c 7.54827
_cell_angle_alpha 109.30333
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 233.23346
_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 0.50000 0.00000 0.50000 1.00000
Ho2 Ho 0.00000 0.50000 0.50000 1.00000
Zr1 Zr 0.00000 0.00000 0.00000 1.00000
Sc1 Sc 0.50000 0.50000 0.00000 1.00000
Bi1 Bi 0.50000 0.24718 0.23806 1.00000
Bi2 Bi 0.50000 0.75282 0.76194 1.00000
Bi3 Bi 0.00000 0.25514 0.76296 1.00000
Bi4 Bi 0.00000 0.74486 0.23704 1.00000
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