Ho7Pb4C
Alexandria ALEXAlex-ID: agm003667096 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C7_98_spg12
Ho5Pb4 Ho5Pb3 Ho4Pb2C
2022-04-08 16:20:24.881598
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003667096).
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 agm003667096
data_agm003667096
_cell_length_a 5.03119
_cell_length_b 9.30470
_cell_length_c 8.46075
_cell_angle_alpha 78.97901
_cell_angle_beta 72.70299
_cell_angle_gamma 74.31447
_cell_volume 361.43026
_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 0.77405 0.86535 0.58655 1.00000
Ho2 Ho 0.22595 0.13465 0.41345 1.00000
Ho3 Ho 0.06067 0.75814 0.12052 1.00000
Ho4 Ho 0.93933 0.24186 0.87948 1.00000
Ho5 Ho 0.36349 0.54279 0.73024 1.00000
Ho6 Ho 0.50000 0.00000 0.00000 1.00000
Ho7 Ho 0.63651 0.45721 0.26976 1.00000
Pb1 Pb 0.58459 0.22018 0.61063 1.00000
Pb2 Pb 0.41541 0.77982 0.38937 1.00000
Pb3 Pb 0.72154 0.65174 0.90518 1.00000
Pb4 Pb 0.27846 0.34826 0.09482 1.00000
C1 C 0.00000 0.00000 0.00000 1.00000
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