Pm2SmN6
Alexandria ALEXAlex-ID: agm097650258 · Space group: Pm (#6)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_1702_spg12
Pm5SmN6 SmN6
2025-04-07 03:33:53
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097650258).
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 agm097650258
data_agm097650258
_cell_length_a 4.89692
_cell_length_b 3.92831
_cell_length_c 7.72341
_cell_angle_alpha 83.48494
_cell_angle_beta 90.44267
_cell_angle_gamma 89.98187
_cell_volume 147.60835
_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 0.94810 0.00809 0.91185 1.00000
Pm2 Pm 0.94240 0.05603 0.44001 1.00000
Sm1 Sm 0.44554 0.55118 0.69937 1.00000
N1 N 0.94496 0.43574 0.12944 1.00000
N2 N 0.44230 0.20147 0.44990 1.00000
N3 N 0.44712 0.03392 0.85719 1.00000
N4 N 0.44130 0.98097 0.35121 1.00000
N5 N 0.94515 0.59267 0.67780 1.00000
N6 N 0.94314 0.63993 0.23324 1.00000
Get direct link