DyTm5Pb6
Alexandria ALEXAlex-ID: agm003678490 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C6_69_spg12
Dy4Tm2Pb5 DyPb2 TmPb
2022-04-09 20:42:48.736744
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003678490).
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 agm003678490
data_agm003678490
_cell_length_a 8.56931
_cell_length_b 6.06730
_cell_length_c 8.20644
_cell_angle_alpha 68.30492
_cell_angle_beta 79.37157
_cell_angle_gamma 60.07058
_cell_volume 343.57978
_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 0.00000 0.00000 0.00000 1.00000
Tm1 Tm 0.50000 0.16484 0.67032 1.00000
Tm2 Tm 0.00000 0.33223 0.33554 1.00000
Tm3 Tm 0.50000 0.50000 0.00000 1.00000
Tm4 Tm 1.00000 0.66777 0.66446 1.00000
Tm5 Tm 0.50000 0.83516 0.32968 1.00000
Pb1 Pb 0.74747 0.08506 0.33540 1.00000
Pb2 Pb 0.25253 0.57954 0.33540 1.00000
Pb3 Pb 0.24804 0.25668 1.00000 1.00000
Pb4 Pb 0.75196 0.74332 0.00000 1.00000
Pb5 Pb 0.74747 0.42046 0.66460 1.00000
Pb6 Pb 0.25253 0.91494 0.66460 1.00000
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