TbPr3Cu2
Alexandria ALEXAlex-ID: agm017432011 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_993_spg12
PrCu Pr TbCu
2025-04-13 19:28:06
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017432011).
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 agm017432011
data_agm017432011
_cell_length_a 8.67867
_cell_length_b 8.67867
_cell_length_c 11.94325
_cell_angle_alpha 53.63056
_cell_angle_beta 126.36944
_cell_angle_gamma 151.77944
_cell_volume 336.59319
_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
Tb1 Tb 0.84446 0.15554 0.24896 1.00000
Tb2 Tb 0.15554 0.84446 0.75104 1.00000
Pr1 Pr 0.15350 0.84650 0.24046 1.00000
Pr2 Pr 0.84650 0.15350 0.75954 1.00000
Pr3 Pr 0.42499 0.57501 0.06822 1.00000
Pr4 Pr 0.57501 0.42499 0.93178 1.00000
Pr5 Pr 0.57890 0.42110 0.44867 1.00000
Pr6 Pr 0.42110 0.57890 0.55133 1.00000
Cu1 Cu 0.23611 0.76389 0.04930 1.00000
Cu2 Cu 0.76389 0.23611 0.95070 1.00000
Cu3 Cu 0.76397 0.23603 0.44955 1.00000
Cu4 Cu 0.23603 0.76397 0.55045 1.00000
Get direct link