Hf2MnB2OsRu4
Alexandria ALEXAlex-ID: agm011297367 · Space group: P2/m (#10)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D2E4_11_spg10
Hf2MnB2Os2Ru3 Hf2MnB2Ru5
2024-07-20 06:40:33.503051
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm011297367).
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 agm011297367
data_agm011297367
_cell_length_a 3.06417
_cell_length_b 9.33817
_cell_length_c 9.33446
_cell_angle_alpha 90.02369
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 267.09409
_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
Hf1 Hf 0.00000 0.82325 0.67635 1.00000
Hf2 Hf 0.00000 0.17675 0.32365 1.00000
Hf3 Hf 0.00000 0.67654 0.17560 1.00000
Hf4 Hf 0.00000 0.32346 0.82440 1.00000
Mn1 Mn 0.00000 0.50000 0.50000 1.00000
Mn2 Mn 0.00000 0.00000 0.00000 1.00000
B1 B 0.00000 0.37635 0.12383 1.00000
B2 B 0.00000 0.62365 0.87617 1.00000
B3 B 0.00000 0.12447 0.62368 1.00000
B4 B 0.00000 0.87553 0.37632 1.00000
Os1 Os 0.50000 0.28673 0.56915 1.00000
Os2 Os 0.50000 0.71327 0.43085 1.00000
Ru1 Ru 0.50000 0.21409 0.07023 1.00000
Ru2 Ru 0.50000 0.78591 0.92977 1.00000
Ru3 Ru 0.50000 0.43090 0.28603 1.00000
Ru4 Ru 0.50000 0.56910 0.71397 1.00000
Ru5 Ru 0.50000 0.93036 0.21369 1.00000
Ru6 Ru 0.50000 0.06964 0.78631 1.00000
Ru7 Ru 0.50000 0.00000 0.50000 1.00000
Ru8 Ru 0.50000 0.50000 0.00000 1.00000
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