LaPm5Tl2In
Alexandria ALEXAlex-ID: agm005176911 · Space group: I4/mcm (#140)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D5_205_spg140
Pm12TlIn3 LaPm5In2 La5Tl3 La2Pm3Tl4
2023-01-07 23:07:05.323929
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005176911).
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 agm005176911
data_agm005176911
_cell_length_a 8.01503
_cell_length_b 8.01503
_cell_length_c 10.91159
_cell_angle_alpha 111.54744
_cell_angle_beta 111.54744
_cell_angle_gamma 90.00000
_cell_volume 598.99988
_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
La1 La 0.25000 0.25000 0.50000 1.00000
La2 La 0.75000 0.75000 0.50000 1.00000
Pm1 Pm 0.93666 0.43666 0.25143 1.00000
Pm2 Pm 0.68523 0.18523 0.74857 1.00000
Pm3 Pm 0.06334 0.56334 0.74857 1.00000
Pm4 Pm 0.18523 0.06334 0.74857 1.00000
Pm5 Pm 0.56334 0.68523 0.74857 1.00000
Pm6 Pm 0.81477 0.93666 0.25143 1.00000
Pm7 Pm 0.43666 0.31477 0.25143 1.00000
Pm8 Pm 0.31477 0.81477 0.25143 1.00000
Pm9 Pm 0.50000 0.50000 0.00000 1.00000
Pm10 Pm 0.00000 0.00000 0.00000 1.00000
Tl1 Tl 0.12469 0.37531 0.00000 1.00000
Tl2 Tl 0.62469 0.12469 0.00000 1.00000
Tl3 Tl 0.37531 0.87531 1.00000 1.00000
Tl4 Tl 0.87531 0.62469 0.00000 1.00000
In1 In 0.25000 0.75000 0.50000 1.00000
In2 In 0.75000 0.25000 0.50000 1.00000
Get direct link