Pr4Bi2TeN2
Alexandria ALEXAlex-ID: agm004564310 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D4_191_spg12
Pr2BiN Pr4Te3N2 PrN PrBi2
2022-06-19 18:05:14.229177
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004564310).
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 agm004564310
data_agm004564310
_cell_length_a 4.29177
_cell_length_b 9.23622
_cell_length_c 8.87826
_cell_angle_alpha 120.76500
_cell_angle_beta 103.98697
_cell_angle_gamma 90.00000
_cell_volume 290.19582
_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 0.22782 0.12787 0.45564 1.00000
Pr2 Pr 0.77218 0.87213 0.54436 1.00000
Pr3 Pr 0.52896 0.77212 0.05793 1.00000
Pr4 Pr 0.47104 0.22788 0.94207 1.00000
Bi1 Bi 0.10127 0.55801 0.20254 1.00000
Bi2 Bi 0.89873 0.44199 0.79746 1.00000
Te1 Te 0.00000 0.00000 0.00000 1.00000
N1 N 0.67898 0.98248 0.35795 1.00000
N2 N 0.32102 0.01752 0.64205 1.00000
Get direct link