Pr3Dy2Te5
Alexandria ALEXAlex-ID: agm005596243 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C5_176_spg12
PrDyTe2 PrTe
2023-06-25 12:27:24.439595
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005596243).
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
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# CIF generated by HEAS from Alexandria entry agm005596243
data_agm005596243
_cell_length_a 4.44091
_cell_length_b 7.72867
_cell_length_c 9.98730
_cell_angle_alpha 96.99281
_cell_angle_beta 77.15418
_cell_angle_gamma 73.30358
_cell_volume 313.73054
_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
Pr1 Pr 0.50000 0.50000 0.50000 1.00000
Pr2 Pr 0.90331 0.88770 0.30567 1.00000
Pr3 Pr 0.09669 0.11230 0.69433 1.00000
Dy1 Dy 0.30543 0.29087 0.09826 1.00000
Dy2 Dy 0.69457 0.70913 0.90174 1.00000
Te1 Te 0.00000 0.00000 0.00000 1.00000
Te2 Te 0.20695 0.19756 0.38855 1.00000
Te3 Te 0.79305 0.80244 0.61145 1.00000
Te4 Te 0.61594 0.58172 0.18640 1.00000
Te5 Te 0.38406 0.41828 0.81360 1.00000
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