PmY2(ErSc)2
Alexandria ALEXAlex-ID: agm017648707 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D2_13_spg12
Pm2Er7 PmY2 YEr5 Sc
2025-06-27 09:23:10
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017648707).
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 agm017648707
data_agm017648707
_cell_length_a 8.28876
_cell_length_b 8.28876
_cell_length_c 8.49244
_cell_angle_alpha 61.90805
_cell_angle_beta 118.09195
_cell_angle_gamma 155.85224
_cell_volume 209.19216
_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
Pm1 Pm 0.00000 0.00000 0.50000 1.00000
Y1 Y 0.70489 0.29511 0.79495 1.00000
Y2 Y 0.29511 0.70489 0.20505 1.00000
Er1 Er 0.63614 0.36386 0.32202 1.00000
Er2 Er 0.36386 0.63614 0.67798 1.00000
Sc1 Sc 0.06994 0.93006 0.93445 1.00000
Sc2 Sc 0.93006 0.06994 0.06555 1.00000
Get direct link