Hf6VRh5
Alexandria ALEXAlex-ID: agm006114732 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C6_55_spg71
Hf2Rh Hf2V3Rh HfRh
2023-09-11 10:34:14.135406
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006114732).
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 agm006114732
data_agm006114732
_cell_length_a 4.58806
_cell_length_b 6.59954
_cell_length_c 7.96504
_cell_angle_alpha 114.47405
_cell_angle_beta 106.73892
_cell_angle_gamma 90.00017
_cell_volume 208.22413
_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
Rh1 Rh 0.33335 0.83335 0.66671 1.00000
Rh2 Rh 0.66899 0.66899 0.33798 1.00000
Rh3 Rh 0.00000 0.50000 0.00000 1.00000
Rh4 Rh 0.33101 0.33101 0.66202 1.00000
Rh5 Rh 0.66665 0.16665 0.33329 1.00000
Hf1 Hf 0.16529 0.41350 0.33057 1.00000
Hf2 Hf 0.16528 0.91707 0.33057 1.00000
Hf3 Hf 0.50000 0.24649 0.00000 1.00000
Hf4 Hf 0.50000 0.75351 1.00000 1.00000
Hf5 Hf 0.83472 0.08293 0.66943 1.00000
Hf6 Hf 0.83471 0.58650 0.66943 1.00000
V1 V 0.00000 0.00000 0.00000 1.00000
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