Ho2TmN3
Alexandria ALEXAlex-ID: agm033722971 · Space group: Fddd (#70)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_36_spg70
HoTm4N5 Ho4TmN5
2024-10-27 07:27:30.915880
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm033722971).
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 agm033722971
data_agm033722971
_cell_length_a 11.38991
_cell_length_b 10.86061
_cell_length_c 5.94835
_cell_angle_alpha 79.47306
_cell_angle_beta 69.63253
_cell_angle_gamma 30.89442
_cell_volume 343.75997
_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
Ho1 Ho 0.49981 0.49981 0.00019 1.00000
Ho2 Ho 0.58348 0.58348 0.41652 1.00000
Ho3 Ho 0.66652 0.66652 0.83348 1.00000
Ho4 Ho 0.75019 0.75019 0.24981 1.00000
Ho5 Ho 0.24981 0.24981 0.75019 1.00000
Ho6 Ho 0.83348 0.83348 0.66652 1.00000
Ho7 Ho 0.41652 0.41652 0.58348 1.00000
Ho8 Ho 0.00019 0.00019 0.49981 1.00000
Tm1 Tm 0.08329 0.08329 0.91671 1.00000
Tm2 Tm 0.16671 0.16671 0.33329 1.00000
Tm3 Tm 0.33329 0.33329 0.16671 1.00000
Tm4 Tm 0.91671 0.91671 0.08329 1.00000
N1 N 0.33169 0.83587 0.16635 1.00000
N2 N 0.83587 0.33169 0.66609 1.00000
N3 N 0.91831 0.41413 0.08365 1.00000
N4 N 0.41413 0.91831 0.58391 1.00000
N5 N 0.49775 0.00225 0.00225 1.00000
N6 N 0.00225 0.49775 0.49775 1.00000
N7 N 0.58391 0.08365 0.41413 1.00000
N8 N 0.08365 0.58391 0.91831 1.00000
N9 N 0.66609 0.16635 0.83587 1.00000
N10 N 0.16635 0.66609 0.33169 1.00000
N11 N 0.75225 0.24775 0.24775 1.00000
N12 N 0.24775 0.75225 0.75225 1.00000
