Pr4BiTe2As
Alexandria ALEXAlex-ID: agm004832905 · Space group: P2/m (#10)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D4_343_spg10
Pr3Bi2Te Pr3Te2As Pr2TeAs
2022-07-13 09:06:00.750568
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004832905).
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 agm004832905
data_agm004832905
_cell_length_a 4.48293
_cell_length_b 7.83321
_cell_length_c 7.84208
_cell_angle_alpha 70.79894
_cell_angle_beta 89.99972
_cell_angle_gamma 89.99968
_cell_volume 260.06128
_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 0.00000 0.73761 0.73823 1.00000
Pr2 Pr 1.00000 0.26239 0.26177 1.00000
Pr3 Pr 0.50000 0.72829 0.27141 1.00000
Pr4 Pr 0.50000 0.27171 0.72859 1.00000
Bi1 Bi 0.50000 0.50000 1.00000 1.00000
Te1 Te 0.00000 0.00000 1.00000 1.00000
Te2 Te 0.50000 0.00000 0.50000 1.00000
As1 As 0.00000 0.49999 0.50000 1.00000
Get direct link