Ac5TbPm2Y
Alexandria ALEXAlex-ID: agm005154232 · Space group: Cmcm (#63)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D5_252_spg36
Pm5Y Tb5Pm3 Ac PmY2
2023-01-19 20:54:30.399575
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005154232).
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 agm005154232
data_agm005154232
_cell_length_a 5.82525
_cell_length_b 11.68365
_cell_length_c 11.09989
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 104.43554
_cell_volume 731.60987
_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
Ac1 Ac 0.37000 0.73999 0.00823 1.00000
Ac2 Ac 0.71828 0.43655 0.82175 1.00000
Ac3 Ac 0.50002 0.00003 0.75812 1.00000
Ac4 Ac 0.28192 0.56384 0.69494 1.00000
Ac5 Ac 0.99751 0.99501 0.50814 1.00000
Ac6 Ac 0.63000 0.26001 0.50823 1.00000
Ac7 Ac 0.28172 0.56345 0.32175 1.00000
Ac8 Ac 0.49998 0.99997 0.25812 1.00000
Ac9 Ac 0.71808 0.43616 0.19494 1.00000
Ac10 Ac 0.00249 0.00499 0.00814 1.00000
Tb1 Tb 0.80284 0.60568 0.50831 1.00000
Tb2 Tb 0.19716 0.39432 0.00831 1.00000
Pm1 Pm 0.88658 0.77316 0.76383 1.00000
Pm2 Pm 0.11356 0.22712 0.75254 1.00000
Pm3 Pm 0.11342 0.22684 0.26383 1.00000
Pm4 Pm 0.88644 0.77288 0.25254 1.00000
Y1 Y 0.59875 0.19750 0.00810 1.00000
Y2 Y 0.40125 0.80250 0.50810 1.00000
Get direct link