Dy7Pb4C
Alexandria ALEXAlex-ID: agm003667095 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C7_98_spg12
Dy5Pb4 Dy5Pb3 Dy4Pb2C
2022-04-08 16:09:59.354484
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003667095).
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 agm003667095
data_agm003667095
_cell_length_a 5.06251
_cell_length_b 9.34622
_cell_length_c 8.48817
_cell_angle_alpha 78.73367
_cell_angle_beta 72.64989
_cell_angle_gamma 74.28622
_cell_volume 366.13842
_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
Dy1 Dy 0.77545 0.86497 0.58413 1.00000
Dy2 Dy 0.22455 0.13503 0.41587 1.00000
Dy3 Dy 0.06133 0.75738 0.11996 1.00000
Dy4 Dy 0.93867 0.24262 0.88004 1.00000
Dy5 Dy 0.36334 0.54237 0.73095 1.00000
Dy6 Dy 0.50000 0.00000 0.00000 1.00000
Dy7 Dy 0.63666 0.45763 0.26905 1.00000
Pb1 Pb 0.58414 0.22025 0.61147 1.00000
Pb2 Pb 0.41586 0.77975 0.38853 1.00000
Pb3 Pb 0.72171 0.65215 0.90443 1.00000
Pb4 Pb 0.27829 0.34785 0.09557 1.00000
C1 C 0.00000 0.00000 0.00000 1.00000
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