Hf6Mn2Pb
Alexandria ALEXAlex-ID: agm005705973 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_1783_spg71
Hf6MnPb2 HfMn2 Hf
2023-07-08 18:19:20.595173
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005705973).
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 agm005705973
data_agm005705973
_cell_length_a 7.81597
_cell_length_b 7.81607
_cell_length_c 7.81607
_cell_angle_alpha 105.52223
_cell_angle_beta 110.80911
_cell_angle_gamma 112.15674
_cell_volume 366.21360
_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 0.47707 0.28143 0.19565 1.00000
Hf2 Hf 0.52293 0.71857 0.80435 1.00000
Hf3 Hf 0.91423 0.71858 0.19565 1.00000
Hf4 Hf 0.08577 0.28142 0.80435 1.00000
Hf5 Hf 0.22052 0.75592 0.97645 1.00000
Hf6 Hf 0.77948 0.24408 0.02355 1.00000
Hf7 Hf 0.77948 0.75592 0.53540 1.00000
Hf8 Hf 0.22052 0.24408 0.46460 1.00000
Hf9 Hf 0.31076 0.98876 0.67800 1.00000
Hf10 Hf 0.68924 0.01124 0.32200 1.00000
Hf11 Hf 0.68924 0.36723 0.67800 1.00000
Hf12 Hf 0.31076 0.63277 0.32200 1.00000
Mn1 Mn 0.50000 0.39007 0.89007 1.00000
Mn2 Mn 0.50000 0.60993 0.10993 1.00000
Mn3 Mn 0.33738 0.99999 0.33739 1.00000
Mn4 Mn 0.66262 0.00000 0.66261 1.00000
Pb1 Pb 0.00000 0.50000 0.50000 1.00000
Pb2 Pb 0.00000 0.00000 0.00000 1.00000
Get direct link