Tb3Ce(YP3)2
Alexandria ALEXAlex-ID: agm033362940 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6_206_spg12
CeY5P6 Tb5CeP6
2024-11-08 17:24:06.897619
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm033362940).
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 agm033362940
data_agm033362940
_cell_length_a 9.00491
_cell_length_b 9.00491
_cell_length_c 8.06678
_cell_angle_alpha 77.07902
_cell_angle_beta 77.07902
_cell_angle_gamma 25.88936
_cell_volume 277.99337
_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 0.50000 0.50000 0.50000 1.00000
Tb2 Tb 0.16789 0.16789 0.66407 1.00000
Tb3 Tb 0.83211 0.83211 0.33593 1.00000
Ce1 Ce 0.50000 0.50000 0.00000 1.00000
Y1 Y 0.83247 0.83247 0.83209 1.00000
Y2 Y 0.16753 0.16753 0.16791 1.00000
P1 P 0.66634 0.66634 0.91733 1.00000
P2 P 0.66654 0.66654 0.41598 1.00000
P3 P 0.33366 0.33366 0.08267 1.00000
P4 P 0.00002 0.00002 0.25014 1.00000
P5 P 0.99998 0.99998 0.74986 1.00000
P6 P 0.33346 0.33346 0.58402 1.00000
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