NdHo3ErTm
Alexandria ALEXAlex-ID: agm005027770 · Space group: Cmcm (#63)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABCD3_465_spg63
Er2Tm Nd3(Ho2Er)2 Nd2Ho7 ErTm2
2022-07-06 07:55:39.716848
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005027770).
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 agm005027770
data_agm005027770
_cell_length_a 5.00249
_cell_length_b 7.91339
_cell_length_c 10.02906
_cell_angle_alpha 90.00004
_cell_angle_beta 89.99624
_cell_angle_gamma 108.47201
_cell_volume 376.56151
_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
Nd1 Nd 0.49976 0.99953 0.75003 1.00000
Nd2 Nd 0.50024 0.00047 0.24997 1.00000
Ho1 Ho 0.66712 0.33443 0.50015 1.00000
Ho2 Ho 0.33288 0.66557 0.49985 1.00000
Ho3 Ho 0.33290 0.66558 0.00014 1.00000
Ho4 Ho 0.66710 0.33442 0.99986 1.00000
Ho5 Ho 0.16851 0.33636 0.75002 1.00000
Ho6 Ho 0.83149 0.66364 0.24998 1.00000
Er1 Er 0.00000 0.00000 0.50000 1.00000
Er2 Er 0.00000 0.00000 0.00000 1.00000
Tm1 Tm 0.83181 0.66432 0.75000 1.00000
Tm2 Tm 0.16819 0.33568 0.25000 1.00000
Get direct link