La2PmTe4
Alexandria ALEXAlex-ID: agm005877342 · Space group: Imma (#74)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_54_spg74
La2(PmTe2)3 La2Te3
2023-10-16 09:59:11
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005877342).
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 agm005877342
data_agm005877342
_cell_length_a 9.05316
_cell_length_b 9.01539
_cell_length_c 9.01539
_cell_angle_alpha 60.67317
_cell_angle_beta 59.86129
_cell_angle_gamma 59.86130
_cell_volume 521.78498
_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 0.00000 0.00000 0.00000 1.00000
La2 La 0.00000 0.00000 0.50000 1.00000
La3 La 0.00000 0.50000 0.50000 1.00000
La4 La 0.50000 0.00000 0.50000 1.00000
Pm1 Pm 0.50000 0.50000 0.00000 1.00000
Pm2 Pm 0.00000 0.50000 0.00000 1.00000
Te1 Te 0.25854 0.24609 0.23682 1.00000
Te2 Te 0.74146 0.26318 0.25391 1.00000
Te3 Te 0.25854 0.73682 0.74609 1.00000
Te4 Te 0.74146 0.75391 0.76318 1.00000
Te5 Te 0.74924 0.74774 0.24774 1.00000
Te6 Te 0.74472 0.25226 0.75226 1.00000
Te7 Te 0.25528 0.74774 0.24774 1.00000
Te8 Te 0.25076 0.25226 0.75226 1.00000
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