Ho2Zr5Mn2
Alexandria ALEXAlex-ID: agm008950488 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C5_485_spg2
ZrMn2 Ho Zr
2024-03-17 12:49:52.120261
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm008950488).
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 agm008950488
data_agm008950488
_cell_length_a 5.88425
_cell_length_b 5.88425
_cell_length_c 11.06478
_cell_angle_alpha 71.16664
_cell_angle_beta 71.16664
_cell_angle_gamma 32.71699
_cell_volume 194.99670
_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 0.32963 0.32963 0.35543 1.00000
Ho2 Ho 0.67037 0.67037 0.64457 1.00000
Zr1 Zr 0.62667 0.62667 0.24304 1.00000
Zr2 Zr 0.37333 0.37333 0.75696 1.00000
Zr3 Zr 0.35215 0.35215 0.04661 1.00000
Zr4 Zr 0.64785 0.64785 0.95339 1.00000
Zr5 Zr 0.00000 0.00000 0.50000 1.00000
Mn1 Mn 0.00820 0.00820 0.13944 1.00000
Mn2 Mn 0.99180 0.99180 0.86056 1.00000
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